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

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)carbonylphenyl]sulfonyl-3-ethyl-urea Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)phenyl]sulfonyl-3-ethyl-urea CAS Name: 1-[4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)-oxomethyl]phenyl]sulfonyl-3-ethylurea IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazole-1-carbonyl)phenyl]sulfonyl-3-ethylurea Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)phenyl]sulfonyl-3-ethyl-urea Formula: C15H17BrN4O4S MolecularWeight: 429.28888

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C15H17BrN4O4S/c1-4-17-15(22)19-25(23,24)12-7-5-11(6-8-12)14(21)20-10(3)13(16)9(2)18-20/h5-8H,4H2,1-3H3,(H2,17,19,22)