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

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]isonipecotamide Formula: C23H26N4O3S2 MolecularWeight: 470.60754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)N4C=CNC4=S)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)N4C=CNC4=S)C

InChI

InChI=1S/C23H26N4O3S2/c1-16-6-7-21(17(2)14-16)32(29,30)26-11-8-18(9-12-26)22(28)25-19-4-3-5-20(15-19)27-13-10-24-23(27)31/h3-7,10,13-15,18H,8-9,11-12H2,1-2H3,(H,24,31)(H,25,28)