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

Systemtic Name: (3S)-N-phenyl-1-[(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)carbonyl]piperidine-3-carboxamide Openeye Name: (3S)-N-phenyl-1-(3-phenyl-2-thioxo-1H-imidazole-4-carbonyl)piperidine-3-carboxamide CAS Name: (3S)-1-[oxo-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-phenyl-1-(3-phenyl-2-sulfanylidene-1H-imidazole-4-carbonyl)piperidine-3-carboxamide Traditional Name: (3S)-N-phenyl-1-(3-phenyl-2-thioxo-4-imidazoline-4-carbonyl)nipecotamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CNC(=S)N2C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CNC(=S)N2C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2S/c27-20(24-17-9-3-1-4-10-17)16-8-7-13-25(15-16)21(28)19-14-23-22(29)26(19)18-11-5-2-6-12-18/h1-6,9-12,14,16H,7-8,13,15H2,(H,23,29)(H,24,27)/t16-/m0/s1