N-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]propyl]-2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]propyl]-2-[(1-methyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-[3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl]-2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-[3-[4-(5-chloro-2-methyl-phenyl)piperazino]propyl]-2-[(2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C26H31ClN4O2S MolecularWeight: 499.06794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCCNC(=O)CSC3=CC(=O)N(C4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCCNC(=O)CSC3=CC(=O)N(C4=CC=CC=C43)C

InChI

InChI=1S/C26H31ClN4O2S/c1-19-8-9-20(27)16-23(19)31-14-12-30(13-15-31)11-5-10-28-25(32)18-34-24-17-26(33)29(2)22-7-4-3-6-21(22)24/h3-4,6-9,16-17H,5,10-15,18H2,1-2H3,(H,28,32)