4-(azepan-1-yl)-N-ethyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(azepan-1-yl)-N-ethyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(azepan-1-yl)-N-ethyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1-azepanyl)-N-ethyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide IUPAC Name: 4-(azepan-1-yl)-N-ethyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(azepan-1-yl)-N-ethyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CCCCCC4

Isomeric SMILES

CCNC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CCCCCC4

InChI

InChI=1S/C22H29N5O/c1-2-23-22(28)27-15-12-19-18(16-27)21(26-13-8-3-4-9-14-26)25-20(24-19)17-10-6-5-7-11-17/h5-7,10-11H,2-4,8-9,12-16H2,1H3,(H,23,28)