Vitas-M small molecule compound
11-{[(E)-(3-methylphenyl)methylidene]amino}-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL156720
SMILES Cc1cccc(c1)/C=N/n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1
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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 C28H22N6O MW 458.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N6O/c1-19-8-7-11-21(16-19)17-30-34-26-24(25-27(34)32-23-13-6-5-12-22(23)31-25)28(35)33(18-29-26)15-14-20-9-3-2-4-10-20/h2-13,16-18H,14-15H2,1H3/b30-17+InChIKey
OOIYBQOEONGJET-OCSSWDANSA-NSynonyms
860808-09-9(E)11((3methylbenzylidene)amino)3phenethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(3methylphenyl)methylidene)amino)3(2phenylethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
860808099
CC1=CC=CC(=C1)C=NN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CCC6=CC=CC=C6
Cc1cccc(c1)C=Nn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1
InChI=1SC28H22N6Oc119871121(1619)1730342624(2527(34)322313651222(23)3125)28(35)33(182926)15142093241020h2131618H1415H21H3b3017+
MFCD04173855
ZINC000002429435
ZINC2429434
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