Vitas-M small molecule compound

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

Catalog ID
STK040788
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)N/N=C/c1ccccc1[N+](=O)[O-]

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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 C23H23ClN6O3S MW 498.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN6O3S/c24-18-12-10-16(11-13-18)22-27-28-23(29(22)19-7-2-1-3-8-19)34-15-21(31)26-25-14-17-6-4-5-9-20(17)30(32)33/h4-6,9-14,19H,1-3,7-8,15H2,(H,26,31)/b25-14+
InChIKey
DGJLZXCTJPXWMG-AFUMVMLFSA-N
Synonyms
499125-97-2
(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(2nitrobenzylidene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(2nitrophenyl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(2NITROPHENYL)METHYLIDENE)ACETOHYDRAZIDE
499125972
C1CCC(CC1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CC=C3(N+)(=O)(O))C4=CC=C(C=C4)Cl
InChI=1SC23H23ClN6O3Sc2418121016(111318)22272823(29(22)197213819)341521(31)26251417645920(17)30(32)33h4691419H137815H2(H2631)b2514+
MFCD03221069
N((1E)2(2NITROPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)NN=Cc1ccccc1(N+)(=O)(O)
STK040788
ZINC000008817221
ZINC33642271

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Available files

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