(2R)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(p-tolylsulfonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide Traditional Name: (2R)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-tosyl-pipecolinamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)N(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@@H]2C(=O)N(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3O3S2/c1-15-10-12-16(13-11-15)29(26,27)24-14-6-5-8-18(24)20(25)23(2)21-22-17-7-3-4-9-19(17)28-21/h3-4,7,9-13,18H,5-6,8,14H2,1-2H3/t18-/m1/s1