(3S)-N-(4-methyl-1,3-thiazol-2-yl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-methyl-1,3-thiazol-2-yl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-(4-methylthiazol-2-yl)piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-(4-methyl-2-thiazolyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-(4-methylthiazol-2-yl)nipecotamide Formula: C16H19N3O3S2 MolecularWeight: 365.47036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CSC(=N1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O3S2/c1-12-11-23-16(17-12)18-15(20)13-6-5-9-19(10-13)24(21,22)14-7-3-2-4-8-14/h2-4,7-8,11,13H,5-6,9-10H2,1H3,(H,17,18,20)/t13-/m0/s1