[1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-[bis(fluoranyl)methylsulfanyl]benzoate

Systemtic Name: [1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-[bis(fluoranyl)methylsulfanyl]benzoate Openeye Name: [2-(cyclopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 4-(difluoromethylsulfanyl)benzoate CAS Name: 4-(difluoromethylthio)benzoic acid [1-[[(cyclopropylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylcarbamoylamino)-1-oxopropan-2-yl] 4-(difluoromethylsulfanyl)benzoate Traditional Name: 4-(difluoromethylthio)benzoic acid [2-(cyclopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H16F2N2O4S MolecularWeight: 358.360346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)OC(=O)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CC(C(=O)NC(=O)NC1CC1)OC(=O)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C15H16F2N2O4S/c1-8(12(20)19-15(22)18-10-4-5-10)23-13(21)9-2-6-11(7-3-9)24-14(16)17/h2-3,6-8,10,14H,4-5H2,1H3,(H2,18,19,20,22)