1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)carbonylphenyl]sulfonyl-3-cyclohexyl-urea

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)carbonylphenyl]sulfonyl-3-cyclohexyl-urea Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)phenyl]sulfonyl-3-cyclohexyl-urea CAS Name: 1-[4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)-oxomethyl]phenyl]sulfonyl-3-cyclohexylurea IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazole-1-carbonyl)phenyl]sulfonyl-3-cyclohexylurea Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)phenyl]sulfonyl-3-cyclohexyl-urea Formula: C19H23BrN4O4S MolecularWeight: 483.37932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3)C)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3)C)Br

InChI

InChI=1S/C19H23BrN4O4S/c1-12-17(20)13(2)24(22-12)18(25)14-8-10-16(11-9-14)29(27,28)23-19(26)21-15-6-4-3-5-7-15/h8-11,15H,3-7H2,1-2H3,(H2,21,23,26)