1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)nipecotamide Formula: C19H20ClN3O3S3 MolecularWeight: 470.0284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)Cl)C

InChI

InChI=1S/C19H20ClN3O3S3/c1-11-8-12(2)17-14(9-11)27-19(21-17)22-18(24)13-4-3-7-23(10-13)29(25,26)16-6-5-15(20)28-16/h5-6,8-9,13H,3-4,7,10H2,1-2H3,(H,21,22,24)