2-[[2-azanyl-3-(6-methylcyclohexa-1,3-dien-1-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[[2-azanyl-3-(6-methylcyclohexa-1,3-dien-1-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[[2-amino-3-(6-methylcyclohexa-1,3-dien-1-yl)propyl]amino]-3,5-dimethyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[[2-amino-3-(6-methyl-1-cyclohexa-1,3-dienyl)propyl]amino]-3,5-dimethyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[[2-amino-3-(6-methylcyclohexa-1,3-dien-1-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[[2-amino-3-(6-methylcyclohexa-1,3-dien-1-yl)propyl]amino]-3,5-dimethyl-6-(4-pyridyl)pyrimidin-4-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=CC=C1CC(CNC2=NC(=C(C(=O)N2C)C)C3=CC=NC=C3)N

Isomeric SMILES

CC1CC=CC=C1CC(CNC2=NC(=C(C(=O)N2C)C)C3=CC=NC=C3)N

InChI

InChI=1S/C21H27N5O/c1-14-6-4-5-7-17(14)12-18(22)13-24-21-25-19(15(2)20(27)26(21)3)16-8-10-23-11-9-16/h4-5,7-11,14,18H,6,12-13,22H2,1-3H3,(H,24,25)