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

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-6-methyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-6-methyl-4-oxo-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-keto-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C21H21F3N4O2S MolecularWeight: 450.47725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC(C3=CSC=C3)N(C)C

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC(C3=CSC=C3)N(C)C

InChI

InChI=1S/C21H21F3N4O2S/c1-13-9-18(29)19(20(30)25-11-17(27(2)3)14-7-8-31-12-14)26-28(13)16-6-4-5-15(10-16)21(22,23)24/h4-10,12,17H,11H2,1-3H3,(H,25,30)