N-[4-(4-hexanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[4-(4-hexanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-(4-hexanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[4-[4-(1-oxohexyl)-1-piperazinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-(4-hexanoylpiperazin-1-yl)phenyl]-2-phenylsulfanylacetamide Traditional Name: N-[4-(4-caproylpiperazino)phenyl]-2-(phenylthio)acetamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2S/c1-2-3-5-10-24(29)27-17-15-26(16-18-27)21-13-11-20(12-14-21)25-23(28)19-30-22-8-6-4-7-9-22/h4,6-9,11-14H,2-3,5,10,15-19H2,1H3,(H,25,28)