(3S)-N-(4-methylpyridin-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-methylpyridin-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(4-methyl-2-pyridyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-(4-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-methylpyridin-2-yl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(4-methyl-2-pyridyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C16H19N3O3S2 MolecularWeight: 365.47036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H19N3O3S2/c1-12-6-7-17-14(10-12)18-16(20)13-4-2-8-19(11-13)24(21,22)15-5-3-9-23-15/h3,5-7,9-10,13H,2,4,8,11H2,1H3,(H,17,18,20)/t13-/m0/s1