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

Systemtic Name: 1-(4,7-dimethylquinazolin-2-yl)-N-phenethyl-azepan-4-amine Openeye Name: 1-(4,7-dimethylquinazolin-2-yl)-N-phenethyl-azepan-4-amine CAS Name: 1-(4,7-dimethyl-2-quinazolinyl)-N-phenethyl-4-azepanamine IUPAC Name: 1-(4,7-dimethylquinazolin-2-yl)-N-phenethylazepan-4-amine Traditional Name: [1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-phenethyl-amine Formula: C24H30N4 MolecularWeight: 374.5218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C24H30N4/c1-18-10-11-22-19(2)26-24(27-23(22)17-18)28-15-6-9-21(13-16-28)25-14-12-20-7-4-3-5-8-20/h3-5,7-8,10-11,17,21,25H,6,9,12-16H2,1-2H3