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

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-phenylsulfanylacetamide Traditional Name: N-[4-(4-butyrylpiperazino)phenyl]-2-(phenylthio)acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-2-6-22(27)25-15-13-24(14-16-25)19-11-9-18(10-12-19)23-21(26)17-28-20-7-4-3-5-8-20/h3-5,7-12H,2,6,13-17H2,1H3,(H,23,26)