N-(1,3-benzothiazol-2-ylmethyl)-1-[2,5-bis(chloranyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-[2,5-bis(chloranyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2,5-dichlorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2,5-dichlorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2,5-dichlorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(2,5-dichlorophenyl)sulfonyl-isonipecotamide Formula: C20H19Cl2N3O3S2 MolecularWeight: 484.41916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3O3S2/c21-14-5-6-15(22)18(11-14)30(27,28)25-9-7-13(8-10-25)20(26)23-12-19-24-16-3-1-2-4-17(16)29-19/h1-6,11,13H,7-10,12H2,(H,23,26)