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

Systemtic Name: 2-(4-methylsulfanylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-(4-methylsulfanylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]acetamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[4-(methylthio)phenyl]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(4-methylsulfanylphenyl)-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-(methylthio)phenyl]-N-[2-(2-thienyl)ethyl]acetamide Formula: C23H22N2O3S4 MolecularWeight: 502.69238

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=C(C=C1)CC(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H22N2O3S4/c1-29-17-7-5-16(6-8-17)14-22(26)25(12-11-18-4-3-13-30-18)23-24-20-10-9-19(32(2,27)28)15-21(20)31-23/h3-10,13,15H,11-12,14H2,1-2H3