6-[4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate

Systemtic Name: 6-[4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Openeye Name: 6-[4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate CAS Name: 6-[4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-oxomethyl]-5-methyl-1-pyrazolyl]-3-pyridazinolate IUPAC Name: 6-[4-[2-(3,4-dimethoxyphenyl)ethyl-methylcarbamoyl]-5-methylpyrazol-1-yl]pyridazin-3-olate Traditional Name: 6-[4-[homoveratryl(methyl)carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Formula: C20H22N5O4- MolecularWeight: 396.41978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NN=C(C=C2)[O-])C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=NN1C2=NN=C(C=C2)[O-])C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H23N5O4/c1-13-15(12-21-25(13)18-7-8-19(26)23-22-18)20(27)24(2)10-9-14-5-6-16(28-3)17(11-14)29-4/h5-8,11-12H,9-10H2,1-4H3,(H,23,26)/p-1