1-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N-benzyl-piperidine-4-carboxamide CAS Name: 1-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N-benzylpiperidine-4-carboxamide Traditional Name: 1-[2-(1,3-benzothiazol-2-ylthio)acetyl]-N-benzyl-isonipecotamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O2S2/c26-20(15-28-22-24-18-8-4-5-9-19(18)29-22)25-12-10-17(11-13-25)21(27)23-14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,23,27)