3-[(2-phenylquinazolin-4-yl)amino]azepan-2-one

Systemtic Name: 3-[(2-phenylquinazolin-4-yl)amino]azepan-2-one Openeye Name: 3-[(2-phenylquinazolin-4-yl)amino]azepan-2-one CAS Name: 3-[(2-phenyl-4-quinazolinyl)amino]-2-azepanone IUPAC Name: 3-[(2-phenylquinazolin-4-yl)amino]azepan-2-one Traditional Name: 3-[(2-phenylquinazolin-4-yl)amino]azepan-2-one Formula: C20H20N4O MolecularWeight: 332.399

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O/c25-20-17(12-6-7-13-21-20)23-19-15-10-4-5-11-16(15)22-18(24-19)14-8-2-1-3-9-14/h1-5,8-11,17H,6-7,12-13H2,(H,21,25)(H,22,23,24)