N-butyl-2-[4-(4-methylsulfanylphenyl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-(4-methylsulfanylphenyl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-(4-methylsulfanylbenzoyl)piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[[4-(methylthio)phenyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-(4-methylsulfanylbenzoyl)piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[4-(methylthio)benzoyl]piperazino]acetamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C18H27N3O2S/c1-3-4-9-19-17(22)14-20-10-12-21(13-11-20)18(23)15-5-7-16(24-2)8-6-15/h5-8H,3-4,9-14H2,1-2H3,(H,19,22)