Vitas-M small molecule compound
3-heptyl-2-methyl-11-(4-methylbenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL161147
SMILES CCCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc(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 C28H31N5O MW 453.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O/c1-4-5-6-7-10-17-32-20(3)29-26-24(28(32)34)25-27(31-23-12-9-8-11-22(23)30-25)33(26)18-21-15-13-19(2)14-16-21/h8-9,11-16H,4-7,10,17-18H2,1-3H3InChIKey
VHENUJLKHLYISI-UHFFFAOYSA-NSynonyms
844662-12-03heptyl2methyl11(4methylbenzyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3heptyl2methyl11(4methylbenzyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844662120
CCCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CC5=CC=C(C=C5)C)C
InChI=1SC28H31N5Oc1456710173220(3)292624(28(32)34)2527(312312981122(23)3025)33(26)1821151319(2)141621h891116H47101718H213H3
MFCD04160038
ZINC000002405181
ZINC2405181
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