4-(azepan-1-yl)-6-prop-2-enyl-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

Systemtic Name: 4-(azepan-1-yl)-6-prop-2-enyl-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Openeye Name: 6-allyl-4-(azepan-1-yl)-2-(2-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine CAS Name: 4-(1-azepanyl)-6-prop-2-enyl-2-(2-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine IUPAC Name: 4-(azepan-1-yl)-6-prop-2-enyl-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Traditional Name: 6-allyl-4-(azepan-1-yl)-2-(2-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Formula: C21H27N5 MolecularWeight: 349.47258

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=N3)N4CCCCCC4

Isomeric SMILES

C=CCN1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=N3)N4CCCCCC4

InChI

InChI=1S/C21H27N5/c1-2-12-25-15-10-18-17(16-25)21(26-13-7-3-4-8-14-26)24-20(23-18)19-9-5-6-11-22-19/h2,5-6,9,11H,1,3-4,7-8,10,12-16H2