1-(3,4-dimethylphenyl)sulfonyl-N-[(1S)-1-thiophen-2-ylethyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(1S)-1-thiophen-2-ylethyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(1S)-1-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(1S)-1-thiophen-2-ylethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(1S)-1-thiophen-2-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(1S)-1-(2-thienyl)ethyl]isonipecotamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N[C@@H](C)C3=CC=CS3)C

InChI

InChI=1S/C20H26N2O3S2/c1-14-6-7-18(13-15(14)2)27(24,25)22-10-8-17(9-11-22)20(23)21-16(3)19-5-4-12-26-19/h4-7,12-13,16-17H,8-11H2,1-3H3,(H,21,23)/t16-/m0/s1