N-(4-acetamidophenyl)-2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-(phenylmethyl)quinolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[(3-benzyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[[3-(phenylmethyl)-2-quinolinyl]thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(3-benzylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(3-benzyl-2-quinolyl)thio]acetamide Formula: C26H23N3O2S MolecularWeight: 441.54472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O2S/c1-18(30)27-22-11-13-23(14-12-22)28-25(31)17-32-26-21(15-19-7-3-2-4-8-19)16-20-9-5-6-10-24(20)29-26/h2-14,16H,15,17H2,1H3,(H,27,30)(H,28,31)