4-(azepan-1-yl)-2-(4-methylphenyl)quinazoline

Systemtic Name: 4-(azepan-1-yl)-2-(4-methylphenyl)quinazoline Openeye Name: 4-(azepan-1-yl)-2-(p-tolyl)quinazoline CAS Name: 4-(1-azepanyl)-2-(4-methylphenyl)quinazoline IUPAC Name: 4-(azepan-1-yl)-2-(4-methylphenyl)quinazoline Traditional Name: 4-(azepan-1-yl)-2-(p-tolyl)quinazoline Formula: C21H23N3 MolecularWeight: 317.42742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N4CCCCCC4

InChI

InChI=1S/C21H23N3/c1-16-10-12-17(13-11-16)20-22-19-9-5-4-8-18(19)21(23-20)24-14-6-2-3-7-15-24/h4-5,8-13H,2-3,6-7,14-15H2,1H3