1-ethanoyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-ethanoyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]isonipecotamide Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)N3C=CNC3=S

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)N3C=CNC3=S

InChI

InChI=1S/C17H20N4O2S/c1-12(22)20-8-5-13(6-9-20)16(23)19-14-3-2-4-15(11-14)21-10-7-18-17(21)24/h2-4,7,10-11,13H,5-6,8-9H2,1H3,(H,18,24)(H,19,23)