methyl 2-[4-[C-methyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-[C-methyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[4-[C-methyl-N-(3-pyridylmethyl)carbonimidoyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetate CAS Name: 2-[5-oxo-1-phenyl-4-[1-(3-pyridinylmethylimino)ethyl]-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[C-methyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetate Traditional Name: 2-[5-keto-4-[C-methyl-N-(3-pyridylmethyl)carbonimidoyl]-1-phenyl-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1=CN=CC=C1)C2C(=NN(C2=O)C3=CC=CC=C3)CC(=O)OC

Isomeric SMILES

CC(=NCC1=CN=CC=C1)C2C(=NN(C2=O)C3=CC=CC=C3)CC(=O)OC

InChI

InChI=1S/C20H20N4O3/c1-14(22-13-15-7-6-10-21-12-15)19-17(11-18(25)27-2)23-24(20(19)26)16-8-4-3-5-9-16/h3-10,12,19H,11,13H2,1-2H3