N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-(4-chlorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-(4-chlorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-(4-chlorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-(4-chlorophenyl)sulfonyl-N-methyl-3-piperidinecarboxamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-(4-chlorophenyl)sulfonyl-N-methylpiperidine-3-carboxamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-(4-chlorophenyl)sulfonyl-N-methyl-nipecotamide Formula: C22H24ClN3O3S2 MolecularWeight: 478.02726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN3O3S2/c1-15(21-24-19-7-3-4-8-20(19)30-21)25(2)22(27)16-6-5-13-26(14-16)31(28,29)18-11-9-17(23)10-12-18/h3-4,7-12,15-16H,5-6,13-14H2,1-2H3