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

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]sulfonyl-3-cyclohexyl-urea Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]sulfonyl-3-cyclohexyl-urea CAS Name: 1-[4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]sulfonyl-3-cyclohexylurea IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]sulfonyl-3-cyclohexylurea Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]sulfonyl-3-cyclohexyl-urea Formula: C18H23BrN4O3S MolecularWeight: 455.36922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3)C)Br

InChI

InChI=1S/C18H23BrN4O3S/c1-12-17(19)13(2)23(21-12)15-8-10-16(11-9-15)27(25,26)22-18(24)20-14-6-4-3-5-7-14/h8-11,14H,3-7H2,1-2H3,(H2,20,22,24)