Vitas-M small molecule compound
4-{[2-methyl-5-(piperidin-1-ylsulfonyl)phenyl]carbonyl}-3,4-dihydroquinoxalin-2(1H)-one
Catalog ID
STL289806
SMILES O=C1Nc2ccccc2N(C1)C(=O)c1cc(ccc1C)S(=O)(=O)N1CCCCC1
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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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-15-9-10-16(29(27,28)23-11-5-2-6-12-23)13-17(15)21(26)24-14-20(25)22-18-7-3-4-8-19(18)24/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,22,25)InChIKey
MTOYBMWXPRAHGJ-UHFFFAOYSA-NSynonyms
4((2methyl5(piperidin1ylsulfonyl)phenyl)carbonyl)34dihydroquinoxalin2(1H)one
4(2METHYL5(PIPERIDINE1SULFONYL)BENZOYL)34DIHYDRO1HQUINOXALIN2ONE
4(2METHYL5PIPERIDIN1YLSULFONYLBENZOYL)13DIHYDROQUINOXALIN2ONE
CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N3CC(=O)NC4=CC=CC=C43
InChI=1SC21H23N3O4Sc11591016(29(2728)23115261223)1317(15)21(26)241420(25)2218734819(18)24h3471013H256111214H21H3(H2225)
MFCD07792650
ZINC000004999578
ZINC04999578
ZINC4999578
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