Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-phenylethylidene]acetohydrazide
Catalog ID
STK081455
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=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 C28H29N5OS MW 483.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5OS/c1-20(21-11-7-5-8-12-21)29-30-25(34)19-35-27-32-31-26(33(27)24-13-9-6-10-14-24)22-15-17-23(18-16-22)28(2,3)4/h5-18H,19H2,1-4H3,(H,30,34)/b29-20+InChIKey
LIDTYGQEMYHDIH-ZTKZIYFRSA-NSynonyms
303107-29-1(Z)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(1phenylethylidene)acetohydrazide
2((5(4tertbutylphenyl)4phenyl124triazol3yl)sulfanyl)N((E)1phenylethylideneamino)acetamide
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((1E)1PHENYLETHYLIDENE)ACETOHYDRAZIDE
303107291
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4
InChI=1SC28H29N5OSc120(21117581221)293025(34)193527323126(33(27)241396101424)22151723(181622)28(23)4h518H19H214H3(H3034)b2920+
MFCD02675637
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=C(c1ccccc1)C
STK081455
ZINC000013893235
ZINC09020140
ZINC9020140
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