Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(3-nitrophenyl)ethylidene]acetohydrazide

Catalog ID
STK072608
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)N/N=C(\c1cccc(c1)[N+](=O)[O-])/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 C24H25ClN6O3S MW 513.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN6O3S/c1-16(18-6-5-9-21(14-18)31(33)34)26-27-22(32)15-35-24-29-28-23(17-10-12-19(25)13-11-17)30(24)20-7-3-2-4-8-20/h5-6,9-14,20H,2-4,7-8,15H2,1H3,(H,27,32)/b26-16-
InChIKey
VUCDNGPALIPQMW-QQXSKIMKSA-N
Synonyms

(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(1(3nitrophenyl)ethylidene)acetohydrazide
2((5(4CHLOROPHENYL)4CYCLOHEXYL124TRIAZOL3YL)SULFANYL)N((Z)1(3NITROPHENYL)ETHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((1Z)1(3NITROPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
CC(=NNC(=O)CSC1=NN=C(N1C2CCCCC2)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC24H25ClN6O3Sc116(1865921(1418)31(33)34)262722(32)153524292823(17101219(25)131117)30(24)207324820h5691420H247815H21H3(H2732)b2616
MFCD03221003
N((1Z)2(3NITROPHENYL)1AZAPROP1ENYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK072608
ZINC000013898851
ZINC08918930
ZINC8918930

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Available files

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