Vitas-M small molecule compound
11-(4-chlorophenyl)-2-methyl-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK920328
SMILES C=CCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Cl
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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 C22H16ClN5O MW 401.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN5O/c1-3-12-27-13(2)24-20-18(22(27)29)19-21(26-17-7-5-4-6-16(17)25-19)28(20)15-10-8-14(23)9-11-15/h3-11H,1,12H2,2H3InChIKey
RPTQKDHUCUBDKA-UHFFFAOYSA-NSynonyms
11(4chlorophenyl)2methyl3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3allyl11(4chlorophenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)Cl)C(=O)N1CC=C
InChI=1SC22H16ClN5Oc13122713(2)242018(22(27)29)1921(2617754616(17)2519)28(20)1510814(23)91115h311H112H22H3
MFCD02993076
ZINC000002298345
ZINC02298345
ZINC2298345
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