1-[7-(4-bromanyl-2-methyl-pyrazol-3-yl)-1-benzofuran-5-yl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[7-(4-bromanyl-2-methyl-pyrazol-3-yl)-1-benzofuran-5-yl]-3-(4-methylphenyl)urea Openeye Name: 1-[7-(4-bromo-2-methyl-pyrazol-3-yl)benzofuran-5-yl]-3-(p-tolyl)urea CAS Name: 1-[7-(4-bromo-2-methyl-3-pyrazolyl)-5-benzofuranyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[7-(4-bromo-2-methylpyrazol-3-yl)-1-benzofuran-5-yl]-3-(4-methylphenyl)urea Traditional Name: 1-[7-(4-bromo-2-methyl-pyrazol-3-yl)benzofuran-5-yl]-3-(p-tolyl)urea Formula: C20H17BrN4O2 MolecularWeight: 425.27858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=CC(=C3C(=C2)C=CO3)C4=C(C=NN4C)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=CC(=C3C(=C2)C=CO3)C4=C(C=NN4C)Br

InChI

InChI=1S/C20H17BrN4O2/c1-12-3-5-14(6-4-12)23-20(26)24-15-9-13-7-8-27-19(13)16(10-15)18-17(21)11-22-25(18)2/h3-11H,1-2H3,(H2,23,24,26)