N-(5-chloranyl-2-methoxy-phenyl)-2-[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[4-oxo-3-(1-phenylethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[4-keto-3-(1-phenylethyl)quinazolin-2-yl]thio]acetamide Formula: C25H22ClN3O3S MolecularWeight: 479.97848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C25H22ClN3O3S/c1-16(17-8-4-3-5-9-17)29-24(31)19-10-6-7-11-20(19)28-25(29)33-15-23(30)27-21-14-18(26)12-13-22(21)32-2/h3-14,16H,15H2,1-2H3,(H,27,30)