[1-[[4-chloranyl-2-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 3-azanylpyrazine-2-carboxylate

Systemtic Name: [1-[[4-chloranyl-2-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 3-azanylpyrazine-2-carboxylate Openeye Name: [2-[4-chloro-2-(trifluoromethyl)anilino]-1-methyl-2-oxo-ethyl] 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid [1-[4-chloro-2-(trifluoromethyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-chloro-2-(trifluoromethyl)anilino]-1-oxopropan-2-yl] 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid [2-[4-chloro-2-(trifluoromethyl)anilino]-2-keto-1-methyl-ethyl] ester Formula: C15H12ClF3N4O3 MolecularWeight: 388.72899

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)OC(=O)C2=NC=CN=C2N

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)OC(=O)C2=NC=CN=C2N

InChI

InChI=1S/C15H12ClF3N4O3/c1-7(26-14(25)11-12(20)22-5-4-21-11)13(24)23-10-3-2-8(16)6-9(10)15(17,18)19/h2-7H,1H3,(H2,20,22)(H,23,24)