Vitas-M small molecule compound

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

Catalog ID
STK036087
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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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 C23H22Cl2N6O3S MW 533.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22Cl2N6O3S/c24-17-9-7-16(8-10-17)22-28-29-23(30(22)18-4-2-1-3-5-18)35-14-21(32)27-26-13-15-6-11-19(25)20(12-15)31(33)34/h6-13,18H,1-5,14H2,(H,27,32)/b26-13+
InChIKey
ROBACSFQBIBGNO-LGJNPRDNSA-N
Synonyms
498568-47-1
(E)N(4chloro3nitrobenzylidene)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)acetohydrazide
498568471
C1CCC(CC1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=C(C=C3)Cl)(N+)(=O)(O))C4=CC=C(C=C4)Cl
InChI=1SC23H22Cl2N6O3Sc24179716(81017)22282923(30(22)184213518)351421(32)2726131561119(25)20(1215)31(33)34h61318H1514H2(H2732)b2613+
MFCD03220978
N((1E)2(4CHLORO3NITROPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(4CHLORO3NITROPHENYL)METHYLIDENE)2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)(4chloro3nitrophenyl)methylideneamino)2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)acetamide
O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)NN=Cc1ccc(c(c1)(N+)(=O)(O))Cl
STK036087
ZINC000097939454
ZINC101421393

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Available files

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