1-methylsulfonyl-N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide Openeye Name: N-[(4-isopropylphenyl)-(2-thienyl)methyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-[p-cumenyl(2-thienyl)methyl]isonipecotamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O3S2/c1-15(2)16-6-8-17(9-7-16)20(19-5-4-14-27-19)22-21(24)18-10-12-23(13-11-18)28(3,25)26/h4-9,14-15,18,20H,10-13H2,1-3H3,(H,22,24)