1-(6-ethoxypyridazin-3-yl)-5-methyl-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyrazole-4-carboxamide

Systemtic Name: 1-(6-ethoxypyridazin-3-yl)-5-methyl-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyrazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(6-ethoxy-3-pyridazinyl)-5-methyl-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-pyrazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-1-(6-ethoxypyridazin-3-yl)-5-methylpyrazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C20H22N6O3/c1-3-29-19-10-9-17(24-25-19)26-14(2)16(12-23-26)20(28)22-13-18(27)21-11-15-7-5-4-6-8-15/h4-10,12H,3,11,13H2,1-2H3,(H,21,27)(H,22,28)