1-methyl-3-(4-nitrophenyl)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea hydrochloride

Systemtic Name: 1-methyl-3-(4-nitrophenyl)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea hydrochloride Openeye Name: 1-methyl-3-(4-nitrophenyl)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea hydrochloride CAS Name: 1-methyl-3-(4-nitrophenyl)-1-[(1,3,5-trimethyl-4-pyrazolyl)methyl]urea hydrochloride IUPAC Name: 1-methyl-3-(4-nitrophenyl)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea hydrochloride Traditional Name: 1-methyl-3-(4-nitrophenyl)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]urea hydrochloride Formula: C15H20ClN5O3 MolecularWeight: 353.804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CN(C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=C(C(=NN1C)C)CN(C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C15H19N5O3.ClH/c1-10-14(11(2)19(4)17-10)9-18(3)15(21)16-12-5-7-13(8-6-12)20(22)23;/h5-8H,9H2,1-4H3,(H,16,21);1H