4-[[3-[(E)-(4-dimethylaminophenyl)methylideneamino]-4-oxidanylidene-quinazolin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[3-[(E)-(4-dimethylaminophenyl)methylideneamino]-4-oxidanylidene-quinazolin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[3-[(E)-(4-dimethylaminophenyl)methyleneamino]-4-oxo-quinazolin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[3-[(E)-(4-dimethylaminophenyl)methylideneamino]-4-oxo-2-quinazolinyl]amino]benzenesulfonamide IUPAC Name: 4-[[3-[(E)-(4-dimethylaminophenyl)methylideneamino]-4-oxoquinazolin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[3-[(E)-[4-(dimethylamino)benzylidene]amino]-4-keto-quinazolin-2-yl]amino]benzenesulfonamide Formula: C23H22N6O3S MolecularWeight: 462.52418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=NN2C(=O)C3=CC=CC=C3N=C2NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=N/N2C(=O)C3=CC=CC=C3N=C2NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C23H22N6O3S/c1-28(2)18-11-7-16(8-12-18)15-25-29-22(30)20-5-3-4-6-21(20)27-23(29)26-17-9-13-19(14-10-17)33(24,31)32/h3-15H,1-2H3,(H,26,27)(H2,24,31,32)/b25-15+