N-(2-methyl-1,3-benzothiazol-6-yl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H20N4O3S2/c1-13-21-17-5-4-15(11-18(17)27-13)22-19(24)14-6-9-23(10-7-14)28(25,26)16-3-2-8-20-12-16/h2-5,8,11-12,14H,6-7,9-10H2,1H3,(H,22,24)