2-[2-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]sulfanylethanamide

Systemtic Name: 2-[2-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]sulfanylethanamide Openeye Name: 2-[2-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]sulfanylacetamide CAS Name: 2-[[2-[[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]phenyl]thio]acetamide IUPAC Name: 2-[2-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: 2-[[2-[3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]thio]acetamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC=C2SCC(=O)N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC=C2SCC(=O)N)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3O2S2/c22-19(25)13-27-17-9-3-1-7-15(17)21(26)24-11-5-6-14(12-24)20-23-16-8-2-4-10-18(16)28-20/h1-4,7-10,14H,5-6,11-13H2,(H2,22,25)