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

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[4-(1,3-benzothiazol-2-ylthio)-1-oxobutyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[4-(1,3-benzothiazol-2-ylthio)butanoyl]-N-phenyl-isonipecotamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H25N3O2S2/c27-21(11-6-16-29-23-25-19-9-4-5-10-20(19)30-23)26-14-12-17(13-15-26)22(28)24-18-7-2-1-3-8-18/h1-5,7-10,17H,6,11-16H2,(H,24,28)