N-(2,2-diethoxyethyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-3-phenyl-propanamide

Systemtic Name: N-(2,2-diethoxyethyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-3-phenyl-propanamide Openeye Name: N-(2,2-diethoxyethyl)-2-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-3-phenyl-propanamide CAS Name: N-(2,2-diethoxyethyl)-2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-phenylpropanamide IUPAC Name: N-(2,2-diethoxyethyl)-2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-phenylpropanamide Traditional Name: N-(2,2-diethoxyethyl)-2-(4-keto-2-thioxo-1H-quinazolin-3-yl)-3-phenyl-propionamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3NC2=S)OCC

Isomeric SMILES

CCOC(CNC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3NC2=S)OCC

InChI

InChI=1S/C23H27N3O4S/c1-3-29-20(30-4-2)15-24-21(27)19(14-16-10-6-5-7-11-16)26-22(28)17-12-8-9-13-18(17)25-23(26)31/h5-13,19-20H,3-4,14-15H2,1-2H3,(H,24,27)(H,25,31)