2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]acetamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OCC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OCC)C

InChI

InChI=1S/C27H27N3O3S/c1-4-19-10-8-9-18(3)25(19)29-24(31)17-34-27-28-23-12-7-6-11-22(23)26(32)30(27)20-13-15-21(16-14-20)33-5-2/h6-16H,4-5,17H2,1-3H3,(H,29,31)