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

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-[6-(methylthio)-1,3-benzothiazol-2-yl]nipecotamide Formula: C18H18ClN3O3S4 MolecularWeight: 488.06682

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C18H18ClN3O3S4/c1-26-12-4-5-13-14(9-12)27-18(20-13)21-17(23)11-3-2-8-22(10-11)29(24,25)16-7-6-15(19)28-16/h4-7,9,11H,2-3,8,10H2,1H3,(H,20,21,23)