3-(4-bromanyl-3-methyl-phenyl)-1-methyl-1-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]urea

Systemtic Name: 3-(4-bromanyl-3-methyl-phenyl)-1-methyl-1-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]urea Openeye Name: 3-(4-bromo-3-methyl-phenyl)-1-methyl-1-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]urea CAS Name: 3-(4-bromo-3-methylphenyl)-1-methyl-1-[2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]urea IUPAC Name: 3-(4-bromo-3-methylphenyl)-1-methyl-1-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]urea Traditional Name: 3-(4-bromo-3-methyl-phenyl)-1-methyl-1-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]urea Formula: C17H23BrN4O MolecularWeight: 379.29472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)N(C)CCC2=C(N(N=C2C)C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)N(C)CCC2=C(N(N=C2C)C)C)Br

InChI

InChI=1S/C17H23BrN4O/c1-11-10-14(6-7-16(11)18)19-17(23)21(4)9-8-15-12(2)20-22(5)13(15)3/h6-7,10H,8-9H2,1-5H3,(H,19,23)