2-(1-ethyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]ethanamide

Systemtic Name: 2-(1-ethyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]ethanamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-[(1-ethyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: 2-[(1-ethyl-2-oxo-4-quinolinyl)thio]-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]acetamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(1-ethyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-2-[(1-ethyl-2-keto-4-quinolyl)thio]acetamide Formula: C26H32N4O2S MolecularWeight: 464.62288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c1-2-30-23-11-7-6-10-22(23)24(18-26(30)32)33-20-25(31)27-12-13-28-14-16-29(17-15-28)19-21-8-4-3-5-9-21/h3-11,18H,2,12-17,19-20H2,1H3,(H,27,31)