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

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-phenoxypropyl)propanamide Openeye Name: 3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-(3-phenoxypropyl)propanamide CAS Name: 3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-phenoxypropyl)propanamide IUPAC Name: 3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-phenoxypropyl)propanamide Traditional Name: 3-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(3-phenoxypropyl)propionamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

C1=CC=C(C=C1)OCCCNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C20H21N3O3S/c24-18(21-12-6-14-26-15-7-2-1-3-8-15)11-13-23-19(25)16-9-4-5-10-17(16)22-20(23)27/h1-5,7-10H,6,11-14H2,(H,21,24)(H,22,27)