N-[4-(azepan-1-yl)phenyl]-2-(7-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-(7-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(7-chloro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-(7-chloro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(7-chloro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(7-chloro-4-keto-quinazolin-3-yl)acetamide Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CN3C=NC4=C(C3=O)C=CC(=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CN3C=NC4=C(C3=O)C=CC(=C4)Cl

InChI

InChI=1S/C22H23ClN4O2/c23-16-5-10-19-20(13-16)24-15-27(22(19)29)14-21(28)25-17-6-8-18(9-7-17)26-11-3-1-2-4-12-26/h5-10,13,15H,1-4,11-12,14H2,(H,25,28)