N-(3,4-dimethoxyphenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H23N3O4S/c1-4-11-24-20(26)15-7-5-6-8-16(15)23-21(24)29-13-19(25)22-14-9-10-17(27-2)18(12-14)28-3/h5-10,12H,4,11,13H2,1-3H3,(H,22,25)