3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(4-phenylmethoxyphenyl)propanamide Openeye Name: N-(4-benzyloxyphenyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: 3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(4-phenylmethoxyphenyl)propanamide IUPAC Name: 3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(4-phenylmethoxyphenyl)propanamide Traditional Name: N-(4-benzoxyphenyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C24H21N3O3S/c28-22(14-15-27-23(29)20-8-4-5-9-21(20)26-24(27)31)25-18-10-12-19(13-11-18)30-16-17-6-2-1-3-7-17/h1-13H,14-16H2,(H,25,28)(H,26,31)