3-(3,4-dimethoxyphenyl)-N-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]propanethioamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]propanethioamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]propanethioamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]propanethioamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]propanethioamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-[3-fluoro-4-(methanesulfonamido)benzyl]thiopropionamide Formula: C19H23FN2O4S2 MolecularWeight: 426.525323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=S)NCC2=CC(=C(C=C2)NS(=O)(=O)C)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=S)NCC2=CC(=C(C=C2)NS(=O)(=O)C)F)OC

InChI

InChI=1S/C19H23FN2O4S2/c1-25-17-8-5-13(11-18(17)26-2)6-9-19(27)21-12-14-4-7-16(15(20)10-14)22-28(3,23)24/h4-5,7-8,10-11,22H,6,9,12H2,1-3H3,(H,21,27)