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

Systemtic Name: 2-[4-oxidanylidene-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-N-propan-2-yl-propanamide Openeye Name: N-isopropyl-2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: 2-[[4-oxo-3-(4-phenoxyphenyl)-2-quinazolinyl]thio]-N-propan-2-ylpropanamide IUPAC Name: 2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanyl-N-propan-2-ylpropanamide Traditional Name: N-isopropyl-2-[[4-keto-3-(4-phenoxyphenyl)quinazolin-2-yl]thio]propionamide Formula: C26H25N3O3S MolecularWeight: 459.56

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3S/c1-17(2)27-24(30)18(3)33-26-28-23-12-8-7-11-22(23)25(31)29(26)19-13-15-21(16-14-19)32-20-9-5-4-6-10-20/h4-18H,1-3H3,(H,27,30)