N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H26N2O4S2/c1-14-6-7-18(26-3)17(13-14)15(2)21-20(23)16-8-10-22(11-9-16)28(24,25)19-5-4-12-27-19/h4-7,12-13,15-16H,8-11H2,1-3H3,(H,21,23)/t15-/m0/s1