N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-4-keto-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C21H17F3N4O3S MolecularWeight: 462.44489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC=C3SCC(=O)N

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC=C3SCC(=O)N

InChI

InChI=1S/C21H17F3N4O3S/c1-12-9-16(29)19(27-28(12)14-6-4-5-13(10-14)21(22,23)24)20(31)26-15-7-2-3-8-17(15)32-11-18(25)30/h2-10H,11H2,1H3,(H2,25,30)(H,26,31)