1-[3-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]propyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]propyl]piperidine-4-carboxamide Openeye Name: 1-[3-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]propyl]piperidine-4-carboxamide CAS Name: 1-[3-[[2-(1,3-benzothiazol-2-ylmethylthio)-1-oxoethyl]amino]propyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]propyl]piperidine-4-carboxamide Traditional Name: 1-[3-[[2-(1,3-benzothiazol-2-ylmethylthio)acetyl]amino]propyl]isonipecotamide Formula: C19H26N4O2S2 MolecularWeight: 406.56534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CCCNC(=O)CSCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CN(CCC1C(=O)N)CCCNC(=O)CSCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H26N4O2S2/c20-19(25)14-6-10-23(11-7-14)9-3-8-21-17(24)12-26-13-18-22-15-4-1-2-5-16(15)27-18/h1-2,4-5,14H,3,6-13H2,(H2,20,25)(H,21,24)