ethyl 2-[2-(4-cyanophenyl)sulfonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-(4-cyanophenyl)sulfonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(4-cyanophenyl)sulfonylhydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[(4-cyanophenyl)sulfonylhydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-cyanophenyl)sulfonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[N'-(4-cyanophenyl)sulfonylhydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C15H12F3N5O4S MolecularWeight: 415.34709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NNS(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NNS(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H12F3N5O4S/c1-2-27-13(24)11-8-20-14(21-12(11)15(16,17)18)22-23-28(25,26)10-5-3-9(7-19)4-6-10/h3-6,8,23H,2H2,1H3,(H,20,21,22)