2-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[(3-chlorophenyl)methyl]-4-piperidyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[1-[(3-chlorophenyl)methyl]-4-piperidinyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[1-(3-chlorobenzyl)-4-piperidyl]acetamide Formula: C21H22ClN3OS2 MolecularWeight: 432.00188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CSC2=NC3=CC=CC=C3S2)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1NC(=O)CSC2=NC3=CC=CC=C3S2)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3OS2/c22-16-5-3-4-15(12-16)13-25-10-8-17(9-11-25)23-20(26)14-27-21-24-18-6-1-2-7-19(18)28-21/h1-7,12,17H,8-11,13-14H2,(H,23,26)