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

Systemtic Name: 1-(4,7-dimethylquinazolin-2-yl)-N-(thiophen-2-ylmethyl)azepan-4-amine Openeye Name: 1-(4,7-dimethylquinazolin-2-yl)-N-(2-thienylmethyl)azepan-4-amine CAS Name: 1-(4,7-dimethyl-2-quinazolinyl)-N-(thiophen-2-ylmethyl)-4-azepanamine IUPAC Name: 1-(4,7-dimethylquinazolin-2-yl)-N-(thiophen-2-ylmethyl)azepan-4-amine Traditional Name: [1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-(2-thenyl)amine Formula: C21H26N4S MolecularWeight: 366.52294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCC4=CC=CS4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCC4=CC=CS4)C

InChI

InChI=1S/C21H26N4S/c1-15-7-8-19-16(2)23-21(24-20(19)13-15)25-10-3-5-17(9-11-25)22-14-18-6-4-12-26-18/h4,6-8,12-13,17,22H,3,5,9-11,14H2,1-2H3