Vitas-M small molecule compound
2-{[5-(2-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{2,4-dimethyl-3-[(methylsulfonyl)amino]benzyl}acetamide
Catalog ID
STK664662
SMILES O=C(NCc1ccc(c(c1C)NS(=O)(=O)C)C)CSc1nnc(n1C1CCCCC1)c1ccccc1Cl
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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 C26H32ClN5O3S2 MW 562.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32ClN5O3S2/c1-17-13-14-19(18(2)24(17)31-37(3,34)35)15-28-23(33)16-36-26-30-29-25(21-11-7-8-12-22(21)27)32(26)20-9-5-4-6-10-20/h7-8,11-14,20,31H,4-6,9-10,15-16H2,1-3H3,(H,28,33)InChIKey
KERYLMPTLCOPMU-UHFFFAOYSA-NSynonyms
2((5(2CHLOROPHENYL)4CYCLOHEXYL124TRIAZOL3YL)SULFANYL)N((3(METHANESULFONAMIDO)24DIMETHYLPHENYL)METHYL)ACETAMIDE
2((5(2chlorophenyl)4cyclohexyl4H124triazol3yl)sulfanyl)N(24dimethyl3((methylsulfonyl)amino)benzyl)acetamide
CC1=C(C(=C(C=C1)CNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4Cl)C)NS(=O)(=O)C
InChI=1SC26H32ClN5O3S2c117131419(18(2)24(17)3137(334)35)152823(33)163626302925(2111781222(21)27)32(26)2095461020h7811142031H469101516H213H3(H2833)
MFCD05860682
ZINC000098007391
ZINC98007391
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