N-(2,5-dimethoxyphenyl)-4-methylsulfanyl-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-4-methylsulfanyl-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: N-(2,5-dimethoxyphenyl)-4-methylsulfanyl-2-(2-thienylsulfonylamino)butanamide CAS Name: N-(2,5-dimethoxyphenyl)-4-(methylthio)-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: N-(2,5-dimethoxyphenyl)-4-methylsulfanyl-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: N-(2,5-dimethoxyphenyl)-4-(methylthio)-2-(2-thienylsulfonylamino)butyramide Formula: C17H22N2O5S3 MolecularWeight: 430.56198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H22N2O5S3/c1-23-12-6-7-15(24-2)14(11-12)18-17(20)13(8-10-25-3)19-27(21,22)16-5-4-9-26-16/h4-7,9,11,13,19H,8,10H2,1-3H3,(H,18,20)