6-(2-chlorophenyl)-8-methyl-2-[(2-oxidanylideneazepan-3-yl)amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 6-(2-chlorophenyl)-8-methyl-2-[(2-oxidanylideneazepan-3-yl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 6-(2-chlorophenyl)-8-methyl-2-[(2-oxoazepan-3-yl)amino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 6-(2-chlorophenyl)-8-methyl-2-[(2-oxo-3-azepanyl)amino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 6-(2-chlorophenyl)-8-methyl-2-[(2-oxoazepan-3-yl)amino]pyrido[2,3-d]pyrimidin-7-one Traditional Name: 6-(2-chlorophenyl)-2-[(2-ketoazepan-3-yl)amino]-8-methyl-pyrido[2,3-d]pyrimidin-7-one Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2C=C(C1=O)C3=CC=CC=C3Cl)NC4CCCCNC4=O

Isomeric SMILES

CN1C2=NC(=NC=C2C=C(C1=O)C3=CC=CC=C3Cl)NC4CCCCNC4=O

InChI

InChI=1S/C20H20ClN5O2/c1-26-17-12(10-14(19(26)28)13-6-2-3-7-15(13)21)11-23-20(25-17)24-16-8-4-5-9-22-18(16)27/h2-3,6-7,10-11,16H,4-5,8-9H2,1H3,(H,22,27)(H,23,24,25)