N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-2-(phenylsulfonyl)-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-2-(phenylsulfonyl)-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-(benzenesulfonyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-(benzenesulfonyl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(benzenesulfonyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-besyl-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-N-[2-(2-thienyl)ethyl]acetamide Formula: C22H20N2O3S4 MolecularWeight: 488.6658

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S4/c1-28-18-10-5-11-19-21(18)23-22(30-19)24(13-12-16-7-6-14-29-16)20(25)15-31(26,27)17-8-3-2-4-9-17/h2-11,14H,12-13,15H2,1H3