N-(6-butyl-1,3-benzothiazol-2-yl)-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-esyl-isonipecotamide Formula: C19H27N3O3S2 MolecularWeight: 409.56598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C19H27N3O3S2/c1-3-5-6-14-7-8-16-17(13-14)26-19(20-16)21-18(23)15-9-11-22(12-10-15)27(24,25)4-2/h7-8,13,15H,3-6,9-12H2,1-2H3,(H,20,21,23)