Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,6-dimethylpiperidin-1-yl)ethanone

Catalog ID
STK104777
SMILES Cc1cccc(c1)n1c(SCC(=O)N2C(C)CCCC2C)nnc1c1ccc(cc1)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 C24H27ClN4OS MW 455.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN4OS/c1-16-6-4-9-21(14-16)29-23(19-10-12-20(25)13-11-19)26-27-24(29)31-15-22(30)28-17(2)7-5-8-18(28)3/h4,6,9-14,17-18H,5,7-8,15H2,1-3H3
InChIKey
LUQPSCJHWKQHNN-UHFFFAOYSA-N
Synonyms

2((5(4CHLOROPHENYL)4(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)1(26DIMETHYLPIPERIDIN1YL)ETHANONE
2((5(4CHLOROPHENYL)4(3METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)1((2R6R)26DIMETHYLPIPERIDIN1YL)ETHANONE
2((5(4CHLOROPHENYL)4(3METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)1((2R6S)26DIMETHYLPIPERIDIN1YL)ETHANONE
2((5(4CHLOROPHENYL)4(3METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)1(26DIMETHYLPIPERIDIN1YL)ETHANONE
5(4CHLOROPHENYL)4(3METHYLPHENYL)4H124TRIAZOL3YL2(26DIMETHYL1PIPERIDINYL)2OXOETHYLSULFIDE
CC1CCCC(N1C(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4=CC=C(C=C4)Cl)C
InChI=1SC24H27ClN4OSc11664921(1416)2923(19101220(25)131119)262724(29)311522(30)2817(2)75818(28)3h469141718H57815H213H3
MFCD03784242
ZINC000002128563
ZINC000017859257

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.