Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-methylphenyl)methylidene]acetohydrazide
Catalog ID
STK013701
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1ccc(cc1)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/c1-20-10-12-21(13-11-20)18-29-30-25(34)19-35-27-32-31-26(33(27)24-8-6-5-7-9-24)22-14-16-23(17-15-22)28(2,3)4/h5-18H,19H2,1-4H3,(H,30,34)/b29-18+InChIKey
WMZYNDSXVSTUAR-RDRPBHBLSA-NSynonyms
361164-44-5(E)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(4methylbenzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)(4METHYLPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(4METHYLPHENYL)METHYLIDENE)ACETOHYDRAZIDE
361164445
CC1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H29N5OSc120101221(131120)18293025(34)193527323126(33(27)248657924)22141623(171522)28(23)4h518H19H214H3(H3034)b2918+
MFCD02641906
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=Cc1ccc(cc1)C
STK013701
ZINC000002329812
ZINC33361189
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