Vitas-M small molecule compound

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

Catalog ID
STK031540
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)N/N=C(\c1ccc(cc1)[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(17-9-13-21(14-10-17)31(33)34)26-27-22(32)15-35-24-29-28-23(18-7-11-19(25)12-8-18)30(24)20-5-3-2-4-6-20/h7-14,20H,2-6,15H2,1H3,(H,27,32)/b26-16-
InChIKey
SXAJWTZGBQAESM-QQXSKIMKSA-N
Synonyms
488803-00-5
(Z)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(1(4nitrophenyl)ethylidene)acetohydrazide
2((5(4CHLOROPHENYL)4CYCLOHEXYL124TRIAZOL3YL)SULFANYL)N((Z)1(4NITROPHENYL)ETHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((1Z)1(4NITROPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
488803005
CC(=NNC(=O)CSC1=NN=C(N1C2CCCCC2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC24H25ClN6O3Sc116(1791321(141017)31(33)34)262722(32)153524292823(1871119(25)12818)30(24)205324620h71420H2615H21H3(H2732)b2616
MFCD03221004
N((1Z)2(4NITROPHENYL)1AZAPROP1ENYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)NN=C(c1ccc(cc1)(N+)(=O)(O))C
STK031540
ZINC000013581969
ZINC08817524
ZINC8817524

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Available files

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