N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(benzylthio)-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)acetamide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)CSCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)CSCC3=CC=CC=C3)OC

InChI

InChI=1S/C18H18N2O3S2/c1-22-14-8-13-16(9-15(14)23-2)25-18(19-13)20-17(21)11-24-10-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3,(H,19,20,21)