[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-methyl-amino]phenyl] pyrazine-2-carboxylate

Systemtic Name: [4-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-methyl-amino]phenyl] pyrazine-2-carboxylate Openeye Name: [4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-methyl-amino]phenyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-methylamino]phenyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [4-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-methyl-amino]phenyl] ester Formula: C19H13ClF3N3O4S MolecularWeight: 471.83743

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)C2=NC=CN=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)C2=NC=CN=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C19H13ClF3N3O4S/c1-26(31(28,29)14-6-7-16(20)15(10-14)19(21,22)23)12-2-4-13(5-3-12)30-18(27)17-11-24-8-9-25-17/h2-11H,1H3