Vitas-M small molecule compound
2-(5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(2,4-dimethylphenyl)acetamide
Catalog ID
STK230435
SMILES O=C(Cc1nnc(n1C)SCC(=O)NC1CCCC1)Nc1ccc(cc1C)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 C20H27N5O2S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O2S/c1-13-8-9-16(14(2)10-13)22-18(26)11-17-23-24-20(25(17)3)28-12-19(27)21-15-6-4-5-7-15/h8-10,15H,4-7,11-12H2,1-3H3,(H,21,27)(H,22,26)InChIKey
NHEKAJMQNUUJNR-UHFFFAOYSA-NSynonyms
2(5((2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(24DIMETHYLPHENYL)ACETAMIDE
2(5(2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(24DIMETHYLPHENYL)ACETAMIDE
2(5CYCLOPENTYLCARBAMOYLMETHYLSULFANYL4METHYL4H(124)TRIAZOL3YL)N(24DIMETHYLPHENYL)ACETAMIDE
CC1=CC(=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)NC3CCCC3)C
InChI=1SC20H27N5O2Sc1138916(14(2)1013)2218(26)1117232420(25(17)3)281219(27)2115645715h81015H471112H213H3(H2127)(H2226)
MFCD07790478
ZINC000004735994
ZINC04735994
ZINC4735994
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