1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]piperidine-3-carboxamide

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]piperidine-3-carboxamide Openeye Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]piperidine-3-carboxamide CAS Name: 1-[4-(1,3-benzothiazol-2-ylthio)-1-oxobutyl]-3-piperidinecarboxamide IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]piperidine-3-carboxamide Traditional Name: 1-[4-(1,3-benzothiazol-2-ylthio)butanoyl]nipecotamide Formula: C17H21N3O2S2 MolecularWeight: 363.49754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCCSC2=NC3=CC=CC=C3S2)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=O)CCCSC2=NC3=CC=CC=C3S2)C(=O)N

InChI

InChI=1S/C17H21N3O2S2/c18-16(22)12-5-3-9-20(11-12)15(21)8-4-10-23-17-19-13-6-1-2-7-14(13)24-17/h1-2,6-7,12H,3-5,8-11H2,(H2,18,22)