Vitas-M small molecule compound

2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]acetohydrazide

Catalog ID
STK791354
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C)N/N=C(/c1ccc2c(c1)cccc2)\C

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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 C29H25N5OS MW 491.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5OS/c1-20-12-14-23(15-13-20)28-32-33-29(34(28)26-10-4-3-5-11-26)36-19-27(35)31-30-21(2)24-17-16-22-8-6-7-9-25(22)18-24/h3-18H,19H2,1-2H3,(H,31,35)/b30-21+
InChIKey
VMVKKTZGZXXQDL-MWAVMZGNSA-N
Synonyms

(Z)N(1(naphthalen2yl)ethylidene)2((4phenyl5(ptolyl)4H124triazol3yl)thio)acetohydrazide
2((5(4methylphenyl)4phenyl124triazol3yl)sulfanyl)N((E)1naphthalen2ylethylideneamino)acetamide
2((5(4methylphenyl)4phenyl4H124triazol3yl)sulfanyl)N((1E)1(naphthalen2yl)ethylidene)acetohydrazide
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=C(C)C4=CC5=CC=CC=C5C=C4
InChI=1SC29H25N5OSc120121423(151320)28323329(34(28)26104351126)361927(35)313021(2)24171622867925(22)1824h318H19H212H3(H3135)b3021+
MFCD02077268
N((1E)2(2NAPHTHYL)1AZAPROP1ENYL)2(5(4METHYLPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C)NN=C(c1ccc2c(c1)cccc2)C
ZINC000004518242
ZINC13661913

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Available files

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