Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-phenylmethylidene]acetohydrazide
Catalog ID
STL362409
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1ccccc1
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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 C27H27N5OS MW 469.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5OS/c1-27(2,3)22-16-14-21(15-17-22)25-30-31-26(32(25)23-12-8-5-9-13-23)34-19-24(33)29-28-18-20-10-6-4-7-11-20/h4-18H,19H2,1-3H3,(H,29,33)/b28-18+InChIKey
GCOHQDXVBLRSHE-MTDXEUNCSA-NSynonyms
361164-30-9(E)Nbenzylidene2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)phenylmethylidene)acetohydrazide
361164309
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC=CC=C4
InChI=1SC27H27N5OSc127(23)22161421(151722)25303126(32(25)23128591323)341924(33)29281820106471120h418H19H213H3(H2933)b2818+
MFCD02641895
N((1E)2PHENYL1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)benzylideneamino)2((5(4tertbutylphenyl)4phenyl124triazol3yl)sulfanyl)acetamide
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=Cc1ccccc1
ZINC000002597490
ZINC33916676
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