N-[4-[4-(2-methoxyphenyl)carbonylpiperazin-1-yl]phenyl]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[4-[4-(2-methoxyphenyl)carbonylpiperazin-1-yl]phenyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[4-[4-(2-methoxybenzoyl)piperazin-1-yl]phenyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[4-[4-[(2-methoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[4-[4-(2-methoxybenzoyl)piperazin-1-yl]phenyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[4-(4-o-anisoylpiperazino)phenyl]-2-(8-quinolylthio)acetamide Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CSC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CSC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C29H28N4O3S/c1-36-25-9-3-2-8-24(25)29(35)33-18-16-32(17-19-33)23-13-11-22(12-14-23)31-27(34)20-37-26-10-4-6-21-7-5-15-30-28(21)26/h2-15H,16-20H2,1H3,(H,31,34)