ethyl (1S,2S)-2-[[(1,5-dimethylpyrazol-3-yl)methyl-pyridin-4-ylcarbonyl-amino]methyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl (1S,2S)-2-[[(1,5-dimethylpyrazol-3-yl)methyl-pyridin-4-ylcarbonyl-amino]methyl]cyclopropane-1-carboxylate Openeye Name: ethyl (1S,2S)-2-[[(1,5-dimethylpyrazol-3-yl)methyl-(pyridine-4-carbonyl)amino]methyl]cyclopropanecarboxylate CAS Name: (1S,2S)-2-[[(1,5-dimethyl-3-pyrazolyl)methyl-[oxo(pyridin-4-yl)methyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S)-2-[[(1,5-dimethylpyrazol-3-yl)methyl-(pyridine-4-carbonyl)amino]methyl]cyclopropane-1-carboxylate Traditional Name: (1S,2S)-2-[[(1,5-dimethylpyrazol-3-yl)methyl-isonicotinoyl-amino]methyl]cyclopropanecarboxylic acid ethyl ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1CN(CC2=NN(C(=C2)C)C)C(=O)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@H]1CN(CC2=NN(C(=C2)C)C)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C19H24N4O3/c1-4-26-19(25)17-10-15(17)11-23(12-16-9-13(2)22(3)21-16)18(24)14-5-7-20-8-6-14/h5-9,15,17H,4,10-12H2,1-3H3/t15-,17+/m1/s1