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

Systemtic Name: 1-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)carbonylphenyl]-3-butyl-urea Openeye Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)phenyl]-3-butyl-urea CAS Name: 1-[4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)-oxomethyl]phenyl]-3-butylurea IUPAC Name: 1-[4-(4-bromo-3,5-dimethylpyrazole-1-carbonyl)phenyl]-3-butylurea Traditional Name: 1-[4-(4-bromo-3,5-dimethyl-pyrazole-1-carbonyl)phenyl]-3-butyl-urea Formula: C17H21BrN4O2 MolecularWeight: 393.27824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=C(C=C1)C(=O)N2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCCCNC(=O)NC1=CC=C(C=C1)C(=O)N2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C17H21BrN4O2/c1-4-5-10-19-17(24)20-14-8-6-13(7-9-14)16(23)22-12(3)15(18)11(2)21-22/h6-9H,4-5,10H2,1-3H3,(H2,19,20,24)