2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(2-methylsulfanylethyl)quinoline-4-carboxamide

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(2-methylsulfanylethyl)quinoline-4-carboxamide Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(2-methylsulfanylethyl)quinoline-4-carboxamide CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazinyl]-N-[2-(methylthio)ethyl]-4-quinolinecarboxamide IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(2-methylsulfanylethyl)quinoline-4-carboxamide Traditional Name: 2-[4-(4-methoxyphenyl)piperazino]-N-[2-(methylthio)ethyl]cinchoninamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCCSC

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCCSC

InChI

InChI=1S/C24H28N4O2S/c1-30-19-9-7-18(8-10-19)27-12-14-28(15-13-27)23-17-21(24(29)25-11-16-31-2)20-5-3-4-6-22(20)26-23/h3-10,17H,11-16H2,1-2H3,(H,25,29)