N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(p-tolylsulfanyl)acetamide CAS Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(p-tolylthio)acetamide Formula: C22H27N3O2S2 MolecularWeight: 429.59868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N(CCCN(C)C)C2=NC3=C(C=CC=C3S2)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N(CCCN(C)C)C2=NC3=C(C=CC=C3S2)OC

InChI

InChI=1S/C22H27N3O2S2/c1-16-9-11-17(12-10-16)28-15-20(26)25(14-6-13-24(2)3)22-23-21-18(27-4)7-5-8-19(21)29-22/h5,7-12H,6,13-15H2,1-4H3