(3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-N-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-benzyl-N-methyl-piperidine-3-carboxamide CAS Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-benzyl-N-methylpiperidine-3-carboxamide Traditional Name: (3S)-N-benzyl-N-methyl-1-piazthiol-4-ylsulfonyl-nipecotamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H22N4O3S2/c1-23(13-15-7-3-2-4-8-15)20(25)16-9-6-12-24(14-16)29(26,27)18-11-5-10-17-19(18)22-28-21-17/h2-5,7-8,10-11,16H,6,9,12-14H2,1H3/t16-/m0/s1