Vitas-M small molecule compound
3-cyclohexyl-11-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK539863
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCCC1
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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 C29H31N5O3 MW 497.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O3/c1-18-30-27-25(29(35)34(18)20-9-5-4-6-10-20)26-28(32-22-12-8-7-11-21(22)31-26)33(27)16-15-19-13-14-23(36-2)24(17-19)37-3/h7-8,11-14,17,20H,4-6,9-10,15-16H2,1-3H3InChIKey
XEOPHUHVVYELDE-UHFFFAOYSA-NSynonyms
371143-50-9371143509
3cyclohexyl11(2(34dimethoxyphenyl)ethyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3cyclohexyl11(34dimethoxyphenethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC(=C(C=C5)OC)OC)C(=O)N1C6CCCCC6
InChI=1SC29H31N5O3c118302725(29(35)34(18)2095461020)2628(322212871121(22)3126)33(27)161519131423(362)24(1719)373h7811141720H469101516H213H3
MFCD03009266
ZINC000002315240
ZINC02315240
ZINC2315240
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