2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclohexyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclohexyl-N-propan-2-yl-ethanamide Openeye Name: 2-[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclohexyl-N-isopropyl-acetamide CAS Name: 2-[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]-N-cyclohexyl-N-propan-2-ylacetamide IUPAC Name: 2-[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclohexyl-N-propan-2-ylacetamide Traditional Name: 2-[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]-N-cyclohexyl-N-isopropyl-acetamide Formula: C26H28N4O2S MolecularWeight: 460.59112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)N(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H28N4O2S/c1-18(2)29(20-8-4-3-5-9-20)24(31)17-33-26-28-23-11-7-6-10-22(23)25(32)30(26)21-14-12-19(16-27)13-15-21/h6-7,10-15,18,20H,3-5,8-9,17H2,1-2H3