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

Systemtic Name: 6-[4-[4-(diphenylmethyl)piperazin-1-yl]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-benzhydrylpiperazin-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-[4-(diphenylmethyl)-1-piperazinyl]-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-benzhydrylpiperazin-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-benzhydrylpiperazino)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C31H28N4O MolecularWeight: 472.58022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H28N4O/c36-28-18-10-8-16-26(28)30-32-27-17-9-7-15-25(27)31(33-30)35-21-19-34(20-22-35)29(23-11-3-1-4-12-23)24-13-5-2-6-14-24/h1-18,29,32H,19-22H2