N-(3-chloranyl-4-fluoranyl-phenyl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C17H13ClFN3O2S MolecularWeight: 377.820423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H13ClFN3O2S/c18-12-9-10(5-6-13(12)19)20-15(23)7-8-22-16(24)11-3-1-2-4-14(11)21-17(22)25/h1-6,9H,7-8H2,(H,20,23)(H,21,25)