3-[(4-bromophenyl)methylamino]-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-quinazolin-4-one

Systemtic Name: 3-[(4-bromophenyl)methylamino]-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-quinazolin-4-one Openeye Name: 3-[(4-bromophenyl)methylamino]-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-quinazolin-4-one CAS Name: 3-[(4-bromophenyl)methylamino]-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-quinazolin-4-one IUPAC Name: 3-[(4-bromophenyl)methylamino]-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-quinazolin-4-one Traditional Name: 3-[(4-bromobenzyl)amino]-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-1H-quinazolin-4-one Formula: C21H16BrN3O2 MolecularWeight: 422.27464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=C3C=CC(=O)C=C3)N2)NCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=C3C=CC(=O)C=C3)N2)NCC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O2/c22-16-9-5-14(6-10-16)13-23-25-20(15-7-11-17(26)12-8-15)24-19-4-2-1-3-18(19)21(25)27/h1-12,23-24H,13H2