N-[2-(cyclohexen-1-yl)ethyl]-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: 2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]propanamide IUPAC Name: 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide Traditional Name: 2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]-N-[2-(cyclohexen-1-yl)ethyl]propionamide Formula: C26H29N3O2S MolecularWeight: 447.59236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NCCC1=CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O2S/c1-19(24(30)27-17-16-20-10-4-2-5-11-20)32-26-28-23-15-9-8-14-22(23)25(31)29(26)18-21-12-6-3-7-13-21/h3,6-10,12-15,19H,2,4-5,11,16-18H2,1H3,(H,27,30)