2-[(3-azanyl-2,2-dimethyl-3-phenyl-propyl)amino]-3-methyl-5-(3-methylphenyl)-6-pyridin-4-yl-pyrimidin-4-one hydrochloride

Systemtic Name: 2-[(3-azanyl-2,2-dimethyl-3-phenyl-propyl)amino]-3-methyl-5-(3-methylphenyl)-6-pyridin-4-yl-pyrimidin-4-one hydrochloride Openeye Name: 2-[(3-amino-2,2-dimethyl-3-phenyl-propyl)amino]-3-methyl-5-(m-tolyl)-6-(4-pyridyl)pyrimidin-4-one hydrochloride CAS Name: 2-[(3-amino-2,2-dimethyl-3-phenylpropyl)amino]-3-methyl-5-(3-methylphenyl)-6-pyridin-4-yl-4-pyrimidinone hydrochloride IUPAC Name: 2-[(3-amino-2,2-dimethyl-3-phenylpropyl)amino]-3-methyl-5-(3-methylphenyl)-6-pyridin-4-ylpyrimidin-4-one hydrochloride Traditional Name: 2-[(3-amino-2,2-dimethyl-3-phenyl-propyl)amino]-3-methyl-5-(m-tolyl)-6-(4-pyridyl)pyrimidin-4-one hydrochloride Formula: C28H32ClN5O MolecularWeight: 490.03958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)NCC(C)(C)C(C3=CC=CC=C3)N)C4=CC=NC=C4.Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(N=C(N(C2=O)C)NCC(C)(C)C(C3=CC=CC=C3)N)C4=CC=NC=C4.Cl

InChI

InChI=1S/C28H31N5O.ClH/c1-19-9-8-12-22(17-19)23-24(20-13-15-30-16-14-20)32-27(33(4)26(23)34)31-18-28(2,3)25(29)21-10-6-5-7-11-21;/h5-17,25H,18,29H2,1-4H3,(H,31,32);1H