Vitas-M small molecule compound
11-(4-methylphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL239843
SMILES C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(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 C22H17N5O MW 367.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O/c1-3-12-26-13-23-20-18(22(26)28)19-21(25-17-7-5-4-6-16(17)24-19)27(20)15-10-8-14(2)9-11-15/h3-11,13H,1,12H2,2H3InChIKey
KQOCUCRZMGMBNB-UHFFFAOYSA-NSynonyms
11(4methylphenyl)3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3allyl11(ptolyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC=C
InChI=1SC22H17N5Oc13122613232018(22(26)28)1921(2517754616(17)2419)27(20)1510814(2)91115h31113H112H22H3
MFCD02982448
ZINC000002284807
ZINC02284807
ZINC2284807
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