(Q27187915)

MLS000047386 (English)

10 October 2016

chemical formula

C₁₉H₂₀ClN₃O₅S

1 reference

MLS000047386 (English)

10 October 2016

canonical SMILES

C1CN(CCN1CC(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Cl

1 reference

MLS000047386 (English)

InChI=1S/C19H20ClN3O5S/c20-14-1-4-16(5-2-14)29(25,26)23-9-7-22(8-10-23)12-19(24)21-15-3-6-17-18(11-15)28-13-27-17/h1-6,11H,7-10,12-13H2,(H,21,24)

10 October 2016

Identifiers

InChI

1 reference

MLS000047386 (English)

ITIBNIJXGYOKFS-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

MLS000047386 (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

N-(1,3-Benzodioxol-5-yl)-2-{4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl}acetamide (English)

10 October 2016

1 reference

MLS000047386 (English)

10 October 2016

ChEBI ID

108942

mapping relation type

2 references

N-(1,3-benzodioxol-5-yl)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]acetamide (English)

matched by identifier from

10 October 2016

International Chemical Identifier

InChI

InChI=1S/C19H20ClN3O5S/c20-14-1-4-16(5-2-14)29(25,26)23-9-7-22(8-10-23)12-19(24)21-15-3-6-17-18(11-15)28-13-27-17/h1-6,11H,7-10,12-13H2,(H,21,24)

1 reference