N-(1,3-benzothiazol-2-ylmethyl)-1-(2-cyanophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-cyanophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-cyanophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-cyanophenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-cyanophenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2-cyanophenyl)sulfonyl-N-methyl-isonipecotamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H22N4O3S2/c1-25(15-21-24-18-7-3-4-8-19(18)30-21)22(27)16-10-12-26(13-11-16)31(28,29)20-9-5-2-6-17(20)14-23/h2-9,16H,10-13,15H2,1H3