N-(4-ethanoylphenyl)-2-[4-oxidanylidene-3-(2-piperidin-1-ylethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[4-oxidanylidene-3-(2-piperidin-1-ylethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-[4-oxo-3-[2-(1-piperidyl)ethyl]quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(4-acetylphenyl)-2-[[4-oxo-3-[2-(1-piperidinyl)ethyl]-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[4-oxo-3-(2-piperidin-1-ylethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[[4-keto-3-(2-piperidinoethyl)quinazolin-2-yl]thio]acetamide Formula: C25H28N4O3S MolecularWeight: 464.57982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCN4CCCCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCN4CCCCC4

InChI

InChI=1S/C25H28N4O3S/c1-18(30)19-9-11-20(12-10-19)26-23(31)17-33-25-27-22-8-4-3-7-21(22)24(32)29(25)16-15-28-13-5-2-6-14-28/h3-4,7-12H,2,5-6,13-17H2,1H3,(H,26,31)