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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN3O3S2/c23-17-7-9-18(10-8-17)31(28,29)26-14-11-16(12-15-26)22(27)24-13-3-6-21-25-19-4-1-2-5-20(19)30-21/h1-2,4-5,7-10,16H,3,6,11-15H2,(H,24,27)