6-(2-methylphenyl)-2-(oxan-4-ylamino)-7-(3-oxidanylpropyl)pyrido[3,4-d]pyrimidin-8-one

Systemtic Name: 6-(2-methylphenyl)-2-(oxan-4-ylamino)-7-(3-oxidanylpropyl)pyrido[3,4-d]pyrimidin-8-one Openeye Name: 7-(3-hydroxypropyl)-6-(o-tolyl)-2-(tetrahydropyran-4-ylamino)pyrido[3,4-d]pyrimidin-8-one CAS Name: 7-(3-hydroxypropyl)-6-(2-methylphenyl)-2-(4-oxanylamino)-8-pyrido[3,4-d]pyrimidinone IUPAC Name: 7-(3-hydroxypropyl)-6-(2-methylphenyl)-2-(oxan-4-ylamino)pyrido[3,4-d]pyrimidin-8-one Traditional Name: 7-(3-hydroxypropyl)-6-(o-tolyl)-2-(tetrahydropyran-4-ylamino)pyrido[3,4-d]pyrimidin-8-one Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=CN=C(N=C3C(=O)N2CCCO)NC4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=CN=C(N=C3C(=O)N2CCCO)NC4CCOCC4

InChI

InChI=1S/C22H26N4O3/c1-15-5-2-3-6-18(15)19-13-16-14-23-22(24-17-7-11-29-12-8-17)25-20(16)21(28)26(19)9-4-10-27/h2-3,5-6,13-14,17,27H,4,7-12H2,1H3,(H,23,24,25)