1-[4-(1,3-benzothiazol-2-ylsulfanyl)phenyl]-2-methyl-2-morpholin-4-yl-propan-1-one

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)phenyl]-2-methyl-2-morpholin-4-yl-propan-1-one Openeye Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)phenyl]-2-methyl-2-morpholino-propan-1-one CAS Name: 1-[4-(1,3-benzothiazol-2-ylthio)phenyl]-2-methyl-2-(4-morpholinyl)-1-propanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)phenyl]-2-methyl-2-morpholin-4-ylpropan-1-one Traditional Name: 1-[4-(1,3-benzothiazol-2-ylthio)phenyl]-2-methyl-2-morpholino-propan-1-one Formula: C21H22N2O2S2 MolecularWeight: 398.54158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)SC2=NC3=CC=CC=C3S2)N4CCOCC4

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)SC2=NC3=CC=CC=C3S2)N4CCOCC4

InChI

InChI=1S/C21H22N2O2S2/c1-21(2,23-11-13-25-14-12-23)19(24)15-7-9-16(10-8-15)26-20-22-17-5-3-4-6-18(17)27-20/h3-10H,11-14H2,1-2H3