Vitas-M small molecule compound
methyl 6-{[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]sulfonyl}-3,4-dihydroquinoline-1(2H)-carboxylate
Catalog ID
STK272031
SMILES COC(=O)N1CCCc2c1ccc(c2)S(=O)(=O)N1CCN(CC1)c1nc2ccccc2nc1c1ccccc1
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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 C29H29N5O4S MW 543.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O4S/c1-38-29(35)34-15-7-10-22-20-23(13-14-26(22)34)39(36,37)33-18-16-32(17-19-33)28-27(21-8-3-2-4-9-21)30-24-11-5-6-12-25(24)31-28/h2-6,8-9,11-14,20H,7,10,15-19H2,1H3InChIKey
CEQWKJICGUWRSX-UHFFFAOYSA-NSynonyms
COC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6
InChI=1SC29H29N5O4Sc13829(35)3415710222023(131426(22)34)39(3637)33181632(171933)2827(218324921)302411561225(24)3128h2689111420H7101519H21H3
methyl6((4(3phenylquinoxalin2yl)piperazin1yl)sulfonyl)34dihydroquinoline1(2H)carboxylate
METHYL6(4(3PHENYLQUINOXALIN2YL)PIPERAZIN1YL)SULFONYL34DIHYDRO2HQUINOLINE1CARBOXYLATE
MFCD06016452
ZINC000098007994
ZINC98007994
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