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

Systemtic Name: ethyl 1-(2-oxidanylpentyl)-5-(propan-2-ylcarbamoylamino)pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-hydroxypentyl)-5-(isopropylcarbamoylamino)pyrazole-4-carboxylate CAS Name: 1-(2-hydroxypentyl)-5-[[oxo-(propan-2-ylamino)methyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxypentyl)-5-(propan-2-ylcarbamoylamino)pyrazole-4-carboxylate Traditional Name: 1-(2-hydroxypentyl)-5-(isopropylcarbamoylamino)pyrazole-4-carboxylic acid ethyl ester Formula: C15H26N4O4 MolecularWeight: 326.39134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN1C(=C(C=N1)C(=O)OCC)NC(=O)NC(C)C)O

Isomeric SMILES

CCCC(CN1C(=C(C=N1)C(=O)OCC)NC(=O)NC(C)C)O

InChI

InChI=1S/C15H26N4O4/c1-5-7-11(20)9-19-13(18-15(22)17-10(3)4)12(8-16-19)14(21)23-6-2/h8,10-11,20H,5-7,9H2,1-4H3,(H2,17,18,22)