methyl 3-[[5-(furan-2-yl)-1H-pyrazol-3-yl]carbonylamino]adamantane-1-carboxylate

Systemtic Name: methyl 3-[[5-(furan-2-yl)-1H-pyrazol-3-yl]carbonylamino]adamantane-1-carboxylate Openeye Name: methyl 3-[[5-(2-furyl)-1H-pyrazole-3-carbonyl]amino]adamantane-1-carboxylate CAS Name: 3-[[[5-(2-furanyl)-1H-pyrazol-3-yl]-oxomethyl]amino]-1-adamantanecarboxylic acid methyl ester IUPAC Name: methyl 3-[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]amino]adamantane-1-carboxylate Traditional Name: 3-[[5-(2-furyl)-1H-pyrazole-3-carbonyl]amino]adamantane-1-carboxylic acid methyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CC3CC(C1)CC(C3)(C2)NC(=O)C4=NNC(=C4)C5=CC=CO5

Isomeric SMILES

COC(=O)C12CC3CC(C1)CC(C3)(C2)NC(=O)C4=NNC(=C4)C5=CC=CO5

InChI

InChI=1S/C20H23N3O4/c1-26-18(25)19-7-12-5-13(8-19)10-20(9-12,11-19)21-17(24)15-6-14(22-23-15)16-3-2-4-27-16/h2-4,6,12-13H,5,7-11H2,1H3,(H,21,24)(H,22,23)