(4S)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-methylpropyl)azepan-4-amine

Systemtic Name: (4S)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-methylpropyl)azepan-4-amine Openeye Name: (4S)-1-(4,7-dimethylquinazolin-2-yl)-N-isobutyl-azepan-4-amine CAS Name: (4S)-1-(4,7-dimethyl-2-quinazolinyl)-N-(2-methylpropyl)-4-azepanamine IUPAC Name: (4S)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-methylpropyl)azepan-4-amine Traditional Name: [(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-isobutyl-amine Formula: C20H30N4 MolecularWeight: 326.479

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC[C@@H](CC3)NCC(C)C)C

InChI

InChI=1S/C20H30N4/c1-14(2)13-21-17-6-5-10-24(11-9-17)20-22-16(4)18-8-7-15(3)12-19(18)23-20/h7-8,12,14,17,21H,5-6,9-11,13H2,1-4H3/t17-/m0/s1