Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]acetohydrazide

Catalog ID
STK083900
SMILES COc1ccc(cc1OC)/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

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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 C26H24ClN5O3S MW 522.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN5O3S/c1-17-4-11-21(12-5-17)32-25(19-7-9-20(27)10-8-19)30-31-26(32)36-16-24(33)29-28-15-18-6-13-22(34-2)23(14-18)35-3/h4-15H,16H2,1-3H3,(H,29,33)/b28-15+
InChIKey
PFKMKCPLOIQOEY-RWPZCVJISA-N
Synonyms
315231-61-9
(E)2((5(4chlorophenyl)4(ptolyl)4H124triazol3yl)thio)N(34dimethoxybenzylidene)acetohydrazide
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(34DIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
315231619
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)Cl
COc1ccc(cc1OC)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl
InChI=1SC26H24ClN5O3Sc11741121(12517)3225(197920(27)10819)303126(32)361624(33)2928151861322(342)23(1418)353h415H16H213H3(H2933)b2815+
MFCD02077474
STK083900
ZINC000002359201
ZINC33362647

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Available files

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