N-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[4-[[(3S,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[4-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[4-[(3S,5S)-3,5-dimethylpiperidino]sulfonylphenyl]-1-(2-thenoyl)isonipecotamide Formula: C24H31N3O4S2 MolecularWeight: 489.65064

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CS4)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CS4)C

InChI

InChI=1S/C24H31N3O4S2/c1-17-14-18(2)16-27(15-17)33(30,31)21-7-5-20(6-8-21)25-23(28)19-9-11-26(12-10-19)24(29)22-4-3-13-32-22/h3-8,13,17-19H,9-12,14-16H2,1-2H3,(H,25,28)/t17-,18-/m0/s1