methyl [4-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanylmethanoate

Systemtic Name: methyl [4-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanylmethanoate Openeye Name: methyl [4-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanylformate CAS Name: [[4-[[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]amino]phenyl]thio]formic acid methyl ester IUPAC Name: methyl [4-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanylformate Traditional Name: [[4-[[3,5-bis(trifluoromethyl)phenyl]carbamoylamino]phenyl]thio]formic acid methyl ester Formula: C17H12F6N2O3S MolecularWeight: 438.344199

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)SC1=CC=C(C=C1)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC(=O)SC1=CC=C(C=C1)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H12F6N2O3S/c1-28-15(27)29-13-4-2-11(3-5-13)24-14(26)25-12-7-9(16(18,19)20)6-10(8-12)17(21,22)23/h2-8H,1H3,(H2,24,25,26)