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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-pyridin-3-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(3-pyridylsulfonyl)piperidine-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(3-pyridinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-pyridin-3-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(3-pyridylsulfonyl)nipecotamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H22N4O4S2/c1-2-28-15-7-8-17-18(11-15)29-20(22-17)23-19(25)14-5-4-10-24(13-14)30(26,27)16-6-3-9-21-12-16/h3,6-9,11-12,14H,2,4-5,10,13H2,1H3,(H,22,23,25)