Vitas-M small molecule compound
N-(3-{2-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-dioxo-1,3,4,6,7,8-hexahydro-2H-pyrido[1,2-a]pyrazin-9-yl}-4-hydroxyphenyl)-4-methylbenzenesulfonamide
Catalog ID
STK689648
SMILES COc1cc(CCN2CC(=O)N3C(=C(CCC3)c3cc(ccc3O)NS(=O)(=O)c3ccc(cc3)C)C2=O)ccc1OC
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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 C31H33N3O7S MW 591.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O7S/c1-20-6-10-23(11-7-20)42(38,39)32-22-9-12-26(35)25(18-22)24-5-4-15-34-29(36)19-33(31(37)30(24)34)16-14-21-8-13-27(40-2)28(17-21)41-3/h6-13,17-18,32,35H,4-5,14-16,19H2,1-3H3InChIKey
YCJKFUYSSHSLAN-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)O)C3=C4C(=O)N(CC(=O)N4CCC3)CCC5=CC(=C(C=C5)OC)OC
InChI=1SC31H33N3O7Sc12061023(11720)42(3839)322291226(35)25(1822)2454153429(36)1933(31(37)30(24)34)16142181327(402)28(1721)413h61317183235H45141619H213H3
MFCD08532439
N(3(2(2(34dimethoxyphenyl)ethyl)14dioxo134678hexahydro2Hpyrido(12a)pyrazin9yl)4hydroxyphenyl)4methylbenzenesulfonamide
N(3(2(2(34dimethoxyphenyl)ethyl)14dioxo3678tetrahydropyrido(12a)pyrazin9yl)4hydroxyphenyl)4methylbenzenesulfonamide
ZINC000098048359
ZINC98048359
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