(Q27210354)

N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide (English)

11 October 2016

chemical formula

C₁₇H₁₄ClN₃O₃S₂

1 reference

N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide (English)

11 October 2016

canonical SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)Cl

1 reference

N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide (English)

InChI=1S/C17H14ClN3O3S2/c18-13-8-6-12(7-9-13)11-25-17-19-15(10-16(22)20-17)21-26(23,24)14-4-2-1-3-5-14/h1-10H,11H2,(H2,19,20,21,22)

11 October 2016

Identifiers

InChI

1 reference

N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide (English)

JLDONEFOBUEJOL-UHFFFAOYSA-N

11 October 2016

InChIKey

2 references

N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

N-{2-[(4-Chlorobenzyl)sulfanyl]-6-oxo-3,6-dihydro-4-pyrimidinyl}benzenesulfonamide (English)

11 October 2016

1 reference

N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide (English)

matched by identifier from

11 October 2016

135463290

1 reference

InChIKey

JLDONEFOBUEJOL-UHFFFAOYSA-N

ChEBI ID

121785

mapping relation type

2 references

N-[2-[(4-chlorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]benzenesulfonamide (English)

matched by identifier from

11 October 2016

International Chemical Identifier

InChI

InChI=1S/C17H14ClN3O3S2/c18-13-8-6-12(7-9-13)11-25-17-19-15(10-16(22)20-17)21-26(23,24)14-4-2-1-3-5-14/h1-10H,11H2,(H2,19,20,21,22)

1 reference

CHEMBL1471486 (English)