1-[1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-ethylphenyl)urea

Systemtic Name: 1-[1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-ethylphenyl)urea Openeye Name: 1-[1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-ethylphenyl)urea CAS Name: 1-[1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-(4-ethylphenyl)urea IUPAC Name: 1-[1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-yl]-3-(4-ethylphenyl)urea Traditional Name: 1-[1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-(4-ethylphenyl)urea Formula: C20H25BrN6O MolecularWeight: 445.3561

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NC2=C(N(N=C2C)CN3C(=C(C(=N3)C)Br)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NC2=C(N(N=C2C)CN3C(=C(C(=N3)C)Br)C)C

InChI

InChI=1S/C20H25BrN6O/c1-6-16-7-9-17(10-8-16)22-20(28)23-19-13(3)25-27(15(19)5)11-26-14(4)18(21)12(2)24-26/h7-10H,6,11H2,1-5H3,(H2,22,23,28)