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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

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