N-(3,4-dimethylphenyl)-1-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-1-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-1-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-1-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-6-oxopyridazine-3-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-1-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-6-keto-pyridazine-3-carboxamide Formula: C22H21FN4O3 MolecularWeight: 408.425543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H21FN4O3/c1-14-3-8-18(11-15(14)2)25-22(30)19-9-10-21(29)27(26-19)13-20(28)24-12-16-4-6-17(23)7-5-16/h3-11H,12-13H2,1-2H3,(H,24,28)(H,25,30)