methyl 5-[[3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3,5-bis(1,3-dimethyl-4-pyrazolyl)-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=CC(=NN2CC3=CC=C(O3)C(=O)OC)C4=CN(N=C4C)C)C

Isomeric SMILES

CC1=NN(C=C1C2=CC(=NN2CC3=CC=C(O3)C(=O)OC)C4=CN(N=C4C)C)C

InChI

InChI=1S/C20H22N6O3/c1-12-15(10-24(3)21-12)17-8-18(16-11-25(4)22-13(16)2)26(23-17)9-14-6-7-19(29-14)20(27)28-5/h6-8,10-11H,9H2,1-5H3