1-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(3-methoxyphenyl)urea

Systemtic Name: 1-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(3-methoxyphenyl)urea CAS Name: 1-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(3-methoxyphenyl)urea Traditional Name: 1-[1-(4-bromobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-(3-methoxyphenyl)urea Formula: C20H21BrN4O2 MolecularWeight: 429.31034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)Br)C)NC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)Br)C)NC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H21BrN4O2/c1-13-19(23-20(26)22-17-5-4-6-18(11-17)27-3)14(2)25(24-13)12-15-7-9-16(21)10-8-15/h4-11H,12H2,1-3H3,(H2,22,23,26)