N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-besyl-N-methyl-nipecotamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c1-23(15-20-22-18-11-5-6-12-19(18)28-20)21(25)16-8-7-13-24(14-16)29(26,27)17-9-3-2-4-10-17/h2-6,9-12,16H,7-8,13-15H2,1H3