6-[4-(azepan-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(azepan-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(azepan-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(1-azepanyl)-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(azepan-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(azepan-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C20H21N3O MolecularWeight: 319.40024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42

Isomeric SMILES

C1CCCN(CC1)C2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42

InChI

InChI=1S/C20H21N3O/c24-18-12-6-4-10-16(18)19-21-17-11-5-3-9-15(17)20(22-19)23-13-7-1-2-8-14-23/h3-6,9-12,21H,1-2,7-8,13-14H2