N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(p-tolylsulfanyl)acetamide CAS Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(p-tolylthio)acetamide Formula: C22H27N3OS2 MolecularWeight: 413.59928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N(CCCN(C)C)C2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N(CCCN(C)C)C2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C22H27N3OS2/c1-16-6-9-18(10-7-16)27-15-21(26)25(13-5-12-24(3)4)22-23-19-11-8-17(2)14-20(19)28-22/h6-11,14H,5,12-13,15H2,1-4H3