N-[2-(4-chlorophenyl)sulfanylethyl]-4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[2-(4-chlorophenyl)sulfanylethyl]-4-oxo-butanamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[2-[(4-chlorophenyl)thio]ethyl]-4-oxobutanamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[2-(4-chlorophenyl)sulfanylethyl]-4-oxobutanamide Traditional Name: 4-(4-acetylpiperazino)-N-[2-[(4-chlorophenyl)thio]ethyl]-4-keto-butyramide Formula: C18H24ClN3O3S MolecularWeight: 397.91946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CCC(=O)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CCC(=O)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H24ClN3O3S/c1-14(23)21-9-11-22(12-10-21)18(25)7-6-17(24)20-8-13-26-16-4-2-15(19)3-5-16/h2-5H,6-13H2,1H3,(H,20,24)