N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-(2-dimethylaminoethyl)-2-(4-methylsulfonylphenyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylphenyl)acetamide Traditional Name: N-(2-dimethylaminoethyl)-2-(4-mesylphenyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]acetamide Formula: C21H25N3O3S3 MolecularWeight: 463.6365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H25N3O3S3/c1-23(2)11-12-24(21-22-18-10-7-16(28-3)14-19(18)29-21)20(25)13-15-5-8-17(9-6-15)30(4,26)27/h5-10,14H,11-13H2,1-4H3