(Q6605919)

639089-54-6 (English)

19 October 2016

chemical formula

C₂₃H₂₈N₈OS

1 reference

639089-54-6 (English)

19 October 2016

canonical SMILES

CC1=CC(=NN1)NC2=NC(=NC(=C2)N3CCN(CC3)C)SC4=CC=C(C=C4)NC(=O)C5CC5

1 reference

639089-54-6 (English)

physically interacts with

19 October 2016

1 reference

17 August 2016

1 reference

17 August 2016

1 reference

InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)

17 August 2016

Identifiers

InChI

1 reference

639089-54-6 (English)

19 October 2016

2 references

639089-54-6 (English)

Global Substance Registration System

19 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

639089-54-6

2 references

stated in

UNII

234335M86K

tozasertib (English)

19 October 2016

https://commonchemistry.cas.org/detail?cas_rn=639089-54-6

9 April 2021

1 reference

Tozasertib (English)

19 October 2016

2 references

639089-54-6 (English)

19 October 2016

ChEBI ID

91336

mapping relation type

2 references

N-[4-[[4-(4-methyl-1-piperazinyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]cyclopropanecarboxamide (English)

19 October 2016

International Chemical Identifier

InChI

InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29)

1 reference

TOZASERTIB (English)

19 October 2016

2 references

inferred from InChIKey

SCHEMBL2682989

2 references

based on heuristic

inferred from InChIKey

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

1 reference

2 references

DSSTOX compound identifier

DTXCID90136100

0 references

1 reference

stated in

Global Substance Registration System

tozasertib (English)

19 October 2016

2 references

UNII

234335M86K

tozasertib (English)

19 October 2016

0 references

0 references

0 references

Microsoft Academic ID

0 references

1 reference

4ZOG (English)

19 October 2016

1 reference

4JBQ (English)

19 October 2016

1 reference

4B8M (English)

19 October 2016

1 reference

2F4J (English)

19 October 2016

1 reference

2XYN (English)

19 October 2016

1 reference

3AMB (English)

19 October 2016

1 reference

4AF3 (English)

19 October 2016

1 reference

3E5A (English)