1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(3-nitrophenyl)urea Openeye Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(3-nitrophenyl)urea CAS Name: 1-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-methoxyphenyl]-3-(3-nitrophenyl)urea IUPAC Name: 1-[3-(4-bromo-2-methylpyrazol-3-yl)-4-methoxyphenyl]-3-(3-nitrophenyl)urea Traditional Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(3-nitrophenyl)urea Formula: C18H16BrN5O4 MolecularWeight: 446.25474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H16BrN5O4/c1-23-17(15(19)10-20-23)14-9-12(6-7-16(14)28-2)22-18(25)21-11-4-3-5-13(8-11)24(26)27/h3-10H,1-2H3,(H2,21,22,25)