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

Systemtic Name: N-(2-ethoxyphenyl)-2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-2-phenyl-ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-phenyl-acetamide CAS Name: N-(2-ethoxyphenyl)-2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]-2-phenylacetamide IUPAC Name: N-(2-ethoxyphenyl)-2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-2-phenylacetamide Traditional Name: 2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]-N-o-phenetyl-2-phenyl-acetamide Formula: C33H31N3O3S MolecularWeight: 549.68254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5C(C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5C(C)C

InChI

InChI=1S/C33H31N3O3S/c1-4-39-29-21-13-11-19-27(29)34-31(37)30(23-14-6-5-7-15-23)40-33-35-26-18-10-8-17-25(26)32(38)36(33)28-20-12-9-16-24(28)22(2)3/h5-22,30H,4H2,1-3H3,(H,34,37)