1-(2-chlorophenyl)carbonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chlorophenyl)carbonyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2-chlorobenzoyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(2-chlorophenyl)-oxomethyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(2-chlorobenzoyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(2-chlorobenzoyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C21H20ClN3O4S2 MolecularWeight: 477.9842

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H20ClN3O4S2/c1-31(28,29)14-6-7-17-18(12-14)30-21(23-17)24-19(26)13-8-10-25(11-9-13)20(27)15-4-2-3-5-16(15)22/h2-7,12-13H,8-11H2,1H3,(H,23,24,26)