6-methyl-4-oxidanylidene-N-(2-thiophen-3-ylethyl)-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name: 6-methyl-4-oxidanylidene-N-(2-thiophen-3-ylethyl)-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: 6-methyl-4-oxo-N-[2-(3-thienyl)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: 6-methyl-4-oxo-N-[2-(3-thiophenyl)ethyl]-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: 6-methyl-4-oxo-N-(2-thiophen-3-ylethyl)-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: 4-keto-6-methyl-N-[2-(3-thienyl)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C19H16F3N3O2S MolecularWeight: 407.40945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NCCC3=CSC=C3

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NCCC3=CSC=C3

InChI

InChI=1S/C19H16F3N3O2S/c1-12-10-16(26)17(18(27)23-8-6-13-7-9-28-11-13)24-25(12)15-5-3-2-4-14(15)19(20,21)22/h2-5,7,9-11H,6,8H2,1H3,(H,23,27)