5,7-bis(azanyl)-3-(3-methylphenyl)-2-[(3-methylphenyl)amino]pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 5,7-bis(azanyl)-3-(3-methylphenyl)-2-[(3-methylphenyl)amino]pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 5,7-diamino-2-(3-methylanilino)-3-(m-tolyl)pyrimido[4,5-d]pyrimidin-4-one CAS Name: 5,7-diamino-2-(3-methylanilino)-3-(3-methylphenyl)-4-pyrimido[4,5-d]pyrimidinone IUPAC Name: 5,7-diamino-2-(3-methylanilino)-3-(3-methylphenyl)pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 5,7-diamino-2-(m-toluidino)-3-(m-tolyl)pyrimido[4,5-d]pyrimidin-4-one Formula: C20H19N7O MolecularWeight: 373.41116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC3=C(C(=NC(=N3)N)N)C(=O)N2C4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC3=C(C(=NC(=N3)N)N)C(=O)N2C4=CC=CC(=C4)C

InChI

InChI=1S/C20H19N7O/c1-11-5-3-7-13(9-11)23-20-26-17-15(16(21)24-19(22)25-17)18(28)27(20)14-8-4-6-12(2)10-14/h3-10H,1-2H3,(H5,21,22,23,24,25,26)