1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C19H20ClN3O3S3 MolecularWeight: 470.0284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl)C

InChI

InChI=1S/C19H20ClN3O3S3/c1-11-3-4-14-17(12(11)2)21-19(27-14)22-18(24)13-7-9-23(10-8-13)29(25,26)16-6-5-15(20)28-16/h3-6,13H,7-10H2,1-2H3,(H,21,22,24)