2-(2-dimethylaminoethylcarbamothioylamino)-N-[2,3,4-tris(fluoranyl)phenyl]ethanamide

Systemtic Name: 2-(2-dimethylaminoethylcarbamothioylamino)-N-[2,3,4-tris(fluoranyl)phenyl]ethanamide Openeye Name: 2-(2-dimethylaminoethylcarbamothioylamino)-N-(2,3,4-trifluorophenyl)acetamide CAS Name: 2-[[(2-dimethylaminoethylamino)-sulfanylidenemethyl]amino]-N-(2,3,4-trifluorophenyl)acetamide IUPAC Name: 2-(2-dimethylaminoethylcarbamothioylamino)-N-(2,3,4-trifluorophenyl)acetamide Traditional Name: 2-(2-dimethylaminoethylthiocarbamoylamino)-N-(2,3,4-trifluorophenyl)acetamide Formula: C13H17F3N4OS MolecularWeight: 334.36049

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)NCC(=O)NC1=C(C(=C(C=C1)F)F)F

Isomeric SMILES

CN(C)CCNC(=S)NCC(=O)NC1=C(C(=C(C=C1)F)F)F

InChI

InChI=1S/C13H17F3N4OS/c1-20(2)6-5-17-13(22)18-7-10(21)19-9-4-3-8(14)11(15)12(9)16/h3-4H,5-7H2,1-2H3,(H,19,21)(H2,17,18,22)