3-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-phenyl-quinazolin-4-one

Systemtic Name: 3-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-phenyl-quinazolin-4-one Openeye Name: 3-[(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-phenyl-quinazolin-4-one CAS Name: 3-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-2-phenyl-4-quinazolinone IUPAC Name: 3-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-2-phenylquinazolin-4-one Traditional Name: 3-[(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-phenyl-quinazolin-4-one Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CNN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CNN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C29H31N3O2/c1-28(2,3)22-16-19(17-23(25(22)33)29(4,5)6)18-30-32-26(20-12-8-7-9-13-20)31-24-15-11-10-14-21(24)27(32)34/h7-18,30H,1-6H3