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

Systemtic Name: N-[4-(4-pentanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-(4-pentanoylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[4-[4-(1-oxopentyl)-1-piperazinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-(4-pentanoylpiperazin-1-yl)phenyl]-2-phenylsulfanylacetamide Traditional Name: 2-(phenylthio)-N-[4-(4-valerylpiperazino)phenyl]acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O2S/c1-2-3-9-23(28)26-16-14-25(15-17-26)20-12-10-19(11-13-20)24-22(27)18-29-21-7-5-4-6-8-21/h4-8,10-13H,2-3,9,14-18H2,1H3,(H,24,27)