N-(3-cyclohexylsulfanylpropyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[3-(cyclohexylthio)propyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-[3-(cyclohexylthio)propyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)isonipecotamide Formula: C24H35N3O2S2 MolecularWeight: 461.6836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCCCSC4CCCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCCCSC4CCCCC4

InChI

InChI=1S/C24H35N3O2S2/c1-2-29-19-9-10-21-22(17-19)31-24(26-21)27-14-11-18(12-15-27)23(28)25-13-6-16-30-20-7-4-3-5-8-20/h9-10,17-18,20H,2-8,11-16H2,1H3,(H,25,28)