1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-3-(2,5-dimethoxyphenyl)urea

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-3-(2,5-dimethoxyphenyl)urea Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-3-(2,5-dimethoxyphenyl)urea CAS Name: 1-[4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]-3-(2,5-dimethoxyphenyl)urea IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]-3-(2,5-dimethoxyphenyl)urea Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-3-(2,5-dimethoxyphenyl)urea Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)NC(=O)NC3=C(C=CC(=C3)OC)OC)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)NC(=O)NC3=C(C=CC(=C3)OC)OC)C)Br

InChI

InChI=1S/C20H21BrN4O3/c1-12-19(21)13(2)25(24-12)15-7-5-14(6-8-15)22-20(26)23-17-11-16(27-3)9-10-18(17)28-4/h5-11H,1-4H3,(H2,22,23,26)