Vitas-M small molecule compound
11-(4-butylphenyl)-3-cyclopentyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL338453
SMILES CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(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 C28H29N5O MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O/c1-3-4-9-19-14-16-21(17-15-19)33-26-24(25-27(33)31-23-13-8-7-12-22(23)30-25)28(34)32(18(2)29-26)20-10-5-6-11-20/h7-8,12-17,20H,3-6,9-11H2,1-2H3InChIKey
HTNGBJMATCIAIL-UHFFFAOYSA-NSynonyms
836645-66-011(4butylphenyl)3cyclopentyl2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4butylphenyl)3cyclopentyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836645660
CCCCC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)C6CCCC6
InChI=1SC28H29N5Oc134919141621(171519)332624(2527(33)312313871222(23)3025)28(34)32(18(2)2926)2010561120h78121720H36911H212H3
MFCD03691560
ZINC000002253267
ZINC02253267
ZINC2253267
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