ethyl 1-(2-oxidanylpropyl)-5-(propan-2-ylcarbamoylamino)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2-oxidanylpropyl)-5-(propan-2-ylcarbamoylamino)pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-hydroxypropyl)-5-(isopropylcarbamoylamino)pyrazole-4-carboxylate CAS Name: 1-(2-hydroxypropyl)-5-[[oxo-(propan-2-ylamino)methyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxypropyl)-5-(propan-2-ylcarbamoylamino)pyrazole-4-carboxylate Traditional Name: 1-(2-hydroxypropyl)-5-(isopropylcarbamoylamino)pyrazole-4-carboxylic acid ethyl ester Formula: C13H22N4O4 MolecularWeight: 298.33818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC(C)O)NC(=O)NC(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC(C)O)NC(=O)NC(C)C

InChI

InChI=1S/C13H22N4O4/c1-5-21-12(19)10-6-14-17(7-9(4)18)11(10)16-13(20)15-8(2)3/h6,8-9,18H,5,7H2,1-4H3,(H2,15,16,20)