1-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]-3-[(3,4-dimethoxyphenyl)methyl]urea

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)NCC3=CC(=C(C=C3)OC)OC)Br

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)NCC3=CC(=C(C=C3)OC)OC)Br

InChI

InChI=1S/C20H21BrN4O3/c1-25-12-16(21)19(24-25)14-5-4-6-15(10-14)23-20(26)22-11-13-7-8-17(27-2)18(9-13)28-3/h4-10,12H,11H2,1-3H3,(H2,22,23,26)