2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(3-phenoxyphenyl)ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(3-phenoxyphenyl)ethanamide Openeye Name: 2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-phenoxyphenyl)acetamide CAS Name: 2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]-N-(3-phenoxyphenyl)acetamide IUPAC Name: 2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-N-(3-phenoxyphenyl)acetamide Traditional Name: 2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]-N-(3-phenoxyphenyl)acetamide Formula: C31H27N3O3S MolecularWeight: 521.62938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C31H27N3O3S/c1-21(2)25-15-7-9-18-28(25)34-30(36)26-16-6-8-17-27(26)33-31(34)38-20-29(35)32-22-11-10-14-24(19-22)37-23-12-4-3-5-13-23/h3-19,21H,20H2,1-2H3,(H,32,35)