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

Systemtic Name: 2-phenylsulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-phenylsulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]acetamide CAS Name: N-[4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: 2-phenylsulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-(phenylthio)-N-[4-(4-propionylpiperazino)phenyl]acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2S/c1-2-21(26)24-14-12-23(13-15-24)18-10-8-17(9-11-18)22-20(25)16-27-19-6-4-3-5-7-19/h3-11H,2,12-16H2,1H3,(H,22,25)