Vitas-M small molecule compound

2-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4,6-dimethyl-N-(2-methylphenyl)pyridine-3-carboxamide

Catalog ID
STK886323
SMILES O=C(NC1CCCC1)CSc1nc(C)cc(c1C(=O)Nc1ccccc1C)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 C22H27N3O2S MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O2S/c1-14-8-4-7-11-18(14)25-21(27)20-15(2)12-16(3)23-22(20)28-13-19(26)24-17-9-5-6-10-17/h4,7-8,11-12,17H,5-6,9-10,13H2,1-3H3,(H,24,26)(H,25,27)
InChIKey
IJGMWDKFBIUDLU-UHFFFAOYSA-N
Synonyms

2((2(cyclopentylamino)2oxoethyl)sulfanyl)46dimethylN(2methylphenyl)pyridine3carboxamide
2(2(cyclopentylamino)2oxoethyl)sulfanyl46dimethylN(2methylphenyl)pyridine3carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)NC3CCCC3
InChI=1SC22H27N3O2Sc1148471118(14)2521(27)2015(2)1216(3)2322(20)281319(26)24179561017h478111217H5691013H213H3(H2426)(H2527)
MFCD10086793
ZINC000009250072
ZINC09250072
ZINC9250072

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Available files

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