Vitas-M small molecule compound
3-cyclopentyl-11-[2-(3,4-dimethoxyphenyl)ethyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK920268
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1ncn(c2=O)C1CCCC1
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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 C27H27N5O3 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3/c1-34-21-12-11-17(15-22(21)35-2)13-14-31-25-23(27(33)32(16-28-25)18-7-3-4-8-18)24-26(31)30-20-10-6-5-9-19(20)29-24/h5-6,9-12,15-16,18H,3-4,7-8,13-14H2,1-2H3InChIKey
QVLINIQKZKFPGR-UHFFFAOYSA-NSynonyms
836634-72-13cyclopentyl11(2(34dimethoxyphenyl)ethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3cyclopentyl11(34dimethoxyphenethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836634721
COC1=C(C=C(C=C1)CCN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)C6CCCC6)OC
InChI=1SC27H27N5O3c13421121117(1522(21)352)1314312523(27(33)32(162825)18734818)2426(31)30201065919(20)2924h56912151618H34781314H212H3
MFCD03689499
ZINC000008834545
ZINC08834545
ZINC8834545
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