1-(4,7-dimethylquinazolin-2-yl)-N-(3-methylbutyl)azepan-4-amine

Systemtic Name: 1-(4,7-dimethylquinazolin-2-yl)-N-(3-methylbutyl)azepan-4-amine Openeye Name: 1-(4,7-dimethylquinazolin-2-yl)-N-isopentyl-azepan-4-amine CAS Name: 1-(4,7-dimethyl-2-quinazolinyl)-N-(3-methylbutyl)-4-azepanamine IUPAC Name: 1-(4,7-dimethylquinazolin-2-yl)-N-(3-methylbutyl)azepan-4-amine Traditional Name: [1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-isoamyl-amine Formula: C21H32N4 MolecularWeight: 340.50558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCCC(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCCC(C)C)C

InChI

InChI=1S/C21H32N4/c1-15(2)9-11-22-18-6-5-12-25(13-10-18)21-23-17(4)19-8-7-16(3)14-20(19)24-21/h7-8,14-15,18,22H,5-6,9-13H2,1-4H3