phenyl 2-azanyl-3-(methylcarbamoylamino)-6-(trifluoromethyl)benzenesulfonate

Systemtic Name: phenyl 2-azanyl-3-(methylcarbamoylamino)-6-(trifluoromethyl)benzenesulfonate Openeye Name: phenyl 2-amino-3-(methylcarbamoylamino)-6-(trifluoromethyl)benzenesulfonate CAS Name: 2-amino-3-(methylcarbamoylamino)-6-(trifluoromethyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 2-amino-3-(methylcarbamoylamino)-6-(trifluoromethyl)benzenesulfonate Traditional Name: 2-amino-3-(methylcarbamoylamino)-6-(trifluoromethyl)benzenesulfonic acid phenyl ester Formula: C15H14F3N3O4S MolecularWeight: 389.34957

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=C(C(=C(C=C1)C(F)(F)F)S(=O)(=O)OC2=CC=CC=C2)N

Isomeric SMILES

CNC(=O)NC1=C(C(=C(C=C1)C(F)(F)F)S(=O)(=O)OC2=CC=CC=C2)N

InChI

InChI=1S/C15H14F3N3O4S/c1-20-14(22)21-11-8-7-10(15(16,17)18)13(12(11)19)26(23,24)25-9-5-3-2-4-6-9/h2-8H,19H2,1H3,(H2,20,21,22)