Vitas-M small molecule compound
2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]acetohydrazide
Catalog ID
STK056394
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C)N/N=C/C(=C/c1ccccc1)/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 C27H25N5OS MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5OS/c1-20-13-15-23(16-14-20)26-30-31-27(32(26)24-11-7-4-8-12-24)34-19-25(33)29-28-18-21(2)17-22-9-5-3-6-10-22/h3-18H,19H2,1-2H3,(H,29,33)/b21-17+,28-18+InChIKey
WHWUHVYMNWEUJE-WUSAKTFYSA-NSynonyms
314287-76-8(E)N((E)2methyl3phenylallylidene)2((4phenyl5(ptolyl)4H124triazol3yl)thio)acetohydrazide
2((5(4METHYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)((E)2METHYL3PHENYLPROP2ENYLIDENE)AMINO)ACETAMIDE
2((5(4METHYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((1E2E)2METHYL3PHENYLPROP2EN1YLIDENE)ACETOHYDRAZIDE
314287768
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC(=CC4=CC=CC=C4)C
InChI=1SC27H25N5OSc120131523(161420)26303127(32(26)24117481224)341925(33)29281821(2)172295361022h318H19H212H3(H2933)b2117+2818+
MFCD02669811
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C)NN=CC(=Cc1ccccc1)C
STK056394
ZINC000002341706
ZINC34720043
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