1-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxy-4-nitro-phenyl)urea

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxy-4-nitro-phenyl)urea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxy-4-nitro-phenyl)urea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-(2-methoxy-4-nitrophenyl)urea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(2-methoxy-4-nitrophenyl)urea Traditional Name: 1-[1-(2-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-(2-methoxy-4-nitro-phenyl)urea Formula: C20H20FN5O4 MolecularWeight: 413.402303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2F)C)NC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2F)C)NC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H20FN5O4/c1-12-19(13(2)25(24-12)11-14-6-4-5-7-16(14)21)23-20(27)22-17-9-8-15(26(28)29)10-18(17)30-3/h4-10H,11H2,1-3H3,(H2,22,23,27)