N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-ethanamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-acetamide CAS Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-(phenylthio)acetamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-phenylsulfanylacetamide Traditional Name: N-[3-(dimethylamino)propyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-(phenylthio)acetamide Formula: C22H27N3OS2 MolecularWeight: 413.59928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCCN(C)C)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCCN(C)C)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C22H27N3OS2/c1-4-17-10-8-13-19-21(17)23-22(28-19)25(15-9-14-24(2)3)20(26)16-27-18-11-6-5-7-12-18/h5-8,10-13H,4,9,14-16H2,1-3H3