Vitas-M small molecule compound
11-(4-butylphenyl)-2-methyl-3-(4-methylbenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714151
SMILES CCCCc1ccc(cc1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccc(cc1)C
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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 C31H29N5O MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N5O/c1-4-5-8-22-15-17-24(18-16-22)36-29-27(28-30(36)34-26-10-7-6-9-25(26)33-28)31(37)35(21(3)32-29)19-23-13-11-20(2)12-14-23/h6-7,9-18H,4-5,8,19H2,1-3H3InChIKey
CBTFBJOQKLFOJE-UHFFFAOYSA-NSynonyms
836645-61-511(4butylphenyl)2methyl3(4methylbenzyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4butylphenyl)2methyl3(4methylbenzyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836645615
CCCCC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CC6=CC=C(C=C6)C
InChI=1SC31H29N5Oc145822151724(181622)362927(2830(36)34261076925(26)3328)31(37)35(21(3)3229)1923131120(2)121423h67918H45819H213H3
MFCD03691552
ZINC000002253250
ZINC02253250
ZINC2253250
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