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4-({[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)-2-hydroxyphenolate

Catalog ID
STK563133
SMILES COc1ccc(cc1)c1n[nH+]c(n1c1ccc(cc1)Cl)SCC(=O)c1ccc(c(c1)O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C23H18ClN3O4S MW 467.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O4S/c1-31-18-9-2-14(3-10-18)22-25-26-23(27(22)17-7-5-16(24)6-8-17)32-13-21(30)15-4-11-19(28)20(29)12-15/h2-12,28-29H,13H2,1H3
InChIKey
FOMSKCHXAFPNBV-UHFFFAOYSA-N
Synonyms
577998-06-2
1(34BIS(OXIDANYL)PHENYL)2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIHYDROXYPHENYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHANONE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)THIO)1(34DIHYDROXYPHENYL)ETHANONE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHAN1ONE
4(((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)2hydroxyphenolate
577998062
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)C4=CC(=C(C=C4)O)O
COc1ccc(cc1)c1n(nH+)c(n1c1ccc(cc1)Cl)SCC(=O)c1ccc(c(c1)O)(O)
InChI=1SC23H18ClN3O4Sc131189214(31018)22252623(27(22)177516(24)6817)321321(30)1541119(28)20(29)1215h2122829H13H21H3
MFCD03223193
ZINC000002361591
ZINC02361591
ZINC2361591

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Available files

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