2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)-2-phenyl-ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)-2-phenyl-acetamide CAS Name: 2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-(4-fluorophenyl)-2-phenylacetamide IUPAC Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)-2-phenylacetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-(4-fluorophenyl)-2-phenyl-acetamide Formula: C25H21ClFN3O3S MolecularWeight: 497.968943

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C25H21ClFN3O3S/c1-33-14-13-30-24(32)20-12-7-17(26)15-21(20)29-25(30)34-22(16-5-3-2-4-6-16)23(31)28-19-10-8-18(27)9-11-19/h2-12,15,22H,13-14H2,1H3,(H,28,31)