(4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C23H15N3O3S MolecularWeight: 413.4485

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H15N3O3S/c24-13-15-7-1-5-11-19(15)30-20-12-6-3-9-17(20)23(28)29-14-21-25-18-10-4-2-8-16(18)22(27)26-21/h1-12H,14H2,(H,25,26,27)