2-[(E)-2-[4-[(4-dimethylaminophenyl)methylideneamino]phenyl]ethenyl]-4-oxidanylidene-1H-quinazoline-6-sulfonic acid

Systemtic Name: 2-[(E)-2-[4-[(4-dimethylaminophenyl)methylideneamino]phenyl]ethenyl]-4-oxidanylidene-1H-quinazoline-6-sulfonic acid Openeye Name: 2-[(E)-2-[4-[(4-dimethylaminophenyl)methyleneamino]phenyl]vinyl]-4-oxo-1H-quinazoline-6-sulfonic acid CAS Name: 2-[(E)-2-[4-[(4-dimethylaminophenyl)methylideneamino]phenyl]ethenyl]-4-oxo-1H-quinazoline-6-sulfonic acid IUPAC Name: 2-[(E)-2-[4-[(4-dimethylaminophenyl)methylideneamino]phenyl]ethenyl]-4-oxo-1H-quinazoline-6-sulfonic acid Traditional Name: 2-[(E)-2-[4-[[4-(dimethylamino)benzylidene]amino]phenyl]vinyl]-4-keto-1H-quinazoline-6-sulfonic acid Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=NC2=CC=C(C=C2)C=CC3=NC(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C=NC2=CC=C(C=C2)/C=C/C3=NC(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)O

InChI

InChI=1S/C25H22N4O4S/c1-29(2)20-10-5-18(6-11-20)16-26-19-8-3-17(4-9-19)7-14-24-27-23-13-12-21(34(31,32)33)15-22(23)25(30)28-24/h3-16H,1-2H3,(H,27,28,30)(H,31,32,33)/b14-7+,26-16?