2-(4-methoxyphenyl)sulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-(4-methoxyphenyl)sulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[(4-methoxyphenyl)thio]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-[(4-methoxyphenyl)thio]-N-[2-(2-thienyl)ethyl]acetamide Formula: C23H22N2O4S4 MolecularWeight: 518.69178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H22N2O4S4/c1-29-16-5-7-18(8-6-16)31-15-22(26)25(12-11-17-4-3-13-30-17)23-24-20-10-9-19(33(2,27)28)14-21(20)32-23/h3-10,13-14H,11-12,15H2,1-2H3