ethyl 5-(2,4-dichlorophenyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylate

Systemtic Name: ethyl 5-(2,4-dichlorophenyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylate Openeye Name: ethyl 5-(2,4-dichlorophenyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylate CAS Name: 5-[(2,4-dichlorophenyl)thio]-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,4-dichlorophenyl)sulfanyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylate Traditional Name: 5-[(2,4-dichlorophenyl)thio]-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylic acid ethyl ester Formula: C19H12Cl2F3N3O2S MolecularWeight: 474.28369

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=N1)C2=CC(=CC=C2)C(F)(F)F)SC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=N1)C2=CC(=CC=C2)C(F)(F)F)SC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H12Cl2F3N3O2S/c1-2-29-18(28)15-17(30-14-7-6-12(20)9-13(14)21)25-16(27-26-15)10-4-3-5-11(8-10)19(22,23)24/h3-9H,2H2,1H3