N-(3-methoxyphenyl)-2-[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-methoxyphenyl)-2-[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-methoxyphenyl)-2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(3-methoxyphenyl)-2-[[4-oxo-3-(1-phenylethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(3-methoxyphenyl)-2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(1-phenylethyl)quinazolin-2-yl]thio]-N-(3-methoxyphenyl)acetamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O3S/c1-17(18-9-4-3-5-10-18)28-24(30)21-13-6-7-14-22(21)27-25(28)32-16-23(29)26-19-11-8-12-20(15-19)31-2/h3-15,17H,16H2,1-2H3,(H,26,29)