(2R)-N-(3-cyanothiophen-2-yl)-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(3-cyanothiophen-2-yl)-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(3-cyano-2-thienyl)-1-(p-tolylsulfonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(3-cyano-2-thiophenyl)-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: (2R)-N-(3-cyanothiophen-2-yl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide Traditional Name: (2R)-N-(3-cyano-2-thienyl)-1-tosyl-pipecolinamide Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@@H]2C(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C18H19N3O3S2/c1-13-5-7-15(8-6-13)26(23,24)21-10-3-2-4-16(21)17(22)20-18-14(12-19)9-11-25-18/h5-9,11,16H,2-4,10H2,1H3,(H,20,22)/t16-/m1/s1