N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfanyl-N-(2-thiophen-2-ylethyl)benzamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfanyl-N-(2-thiophen-2-ylethyl)benzamide Openeye Name: 3-isopropylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]benzamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(propan-2-ylthio)-N-(2-thiophen-2-ylethyl)benzamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfanyl-N-(2-thiophen-2-ylethyl)benzamide Traditional Name: 3-(isopropylthio)-N-(6-mesyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]benzamide Formula: C24H24N2O3S4 MolecularWeight: 516.71896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1)C(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)SC1=CC=CC(=C1)C(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C24H24N2O3S4/c1-16(2)31-19-7-4-6-17(14-19)23(27)26(12-11-18-8-5-13-30-18)24-25-21-10-9-20(33(3,28)29)15-22(21)32-24/h4-10,13-16H,11-12H2,1-3H3