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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CN=CC=C4

InChI

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