(2S)-3-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-methyl-2-(3-nitrophenyl)-1H-quinazolin-4-one

Systemtic Name: (2S)-3-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-methyl-2-(3-nitrophenyl)-1H-quinazolin-4-one Openeye Name: (2S)-3-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-methyl-2-(3-nitrophenyl)-1H-quinazolin-4-one CAS Name: (2S)-3-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-2-methyl-2-(3-nitrophenyl)-1H-quinazolin-4-one IUPAC Name: (2S)-3-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-2-methyl-2-(3-nitrophenyl)-1H-quinazolin-4-one Traditional Name: (2S)-3-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-methyl-2-(3-nitrophenyl)-1H-quinazolin-4-one Formula: C23H19BrN4O5 MolecularWeight: 511.32476

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NC2=CC=CC=C2C(=O)N1NC=C3C=C(C(=O)C(=C3)Br)OC)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@@]1(NC2=CC=CC=C2C(=O)N1NC=C3C=C(C(=O)C(=C3)Br)OC)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19BrN4O5/c1-23(15-6-5-7-16(12-15)28(31)32)26-19-9-4-3-8-17(19)22(30)27(23)25-13-14-10-18(24)21(29)20(11-14)33-2/h3-13,25-26H,1-2H3/t23-/m0/s1