1-(3-methylsulfanylpropylcarbamothioyl)-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-(3-methylsulfanylpropylcarbamothioyl)-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-(3-methylsulfanylpropylcarbamothioyl)-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[[3-(methylthio)propylamino]-sulfanylidenemethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-(3-methylsulfanylpropylcarbamothioyl)-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[3-(methylthio)propylthiocarbamoyl]-N-phenyl-isonipecotamide Formula: C17H25N3OS2 MolecularWeight: 351.5299

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCC(CC1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CSCCCNC(=S)N1CCC(CC1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H25N3OS2/c1-23-13-5-10-18-17(22)20-11-8-14(9-12-20)16(21)19-15-6-3-2-4-7-15/h2-4,6-7,14H,5,8-13H2,1H3,(H,18,22)(H,19,21)