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

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H23N3O3S3/c1-14(19-21-16-6-3-4-7-17(16)28-19)22(2)20(24)15-9-11-23(12-10-15)29(25,26)18-8-5-13-27-18/h3-8,13-15H,9-12H2,1-2H3