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

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(4-dimethylaminophenyl)urea Openeye Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(4-dimethylaminophenyl)urea CAS Name: 1-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-methoxyphenyl]-3-(4-dimethylaminophenyl)urea IUPAC Name: 1-[3-(4-bromo-2-methylpyrazol-3-yl)-4-methoxyphenyl]-3-(4-dimethylaminophenyl)urea Traditional Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-3-(4-dimethylaminophenyl)urea Formula: C20H22BrN5O2 MolecularWeight: 444.32498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)N(C)C)OC

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)N(C)C)OC

InChI

InChI=1S/C20H22BrN5O2/c1-25(2)15-8-5-13(6-9-15)23-20(27)24-14-7-10-18(28-4)16(11-14)19-17(21)12-22-26(19)3/h5-12H,1-4H3,(H2,23,24,27)