1-(3-bromophenyl)-3-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]urea

Systemtic Name: 1-(3-bromophenyl)-3-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]urea Openeye Name: 1-(3-bromophenyl)-3-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]urea CAS Name: 1-(3-bromophenyl)-3-[2-(1-ethyl-3,5-dimethyl-4-pyrazolyl)ethyl]urea IUPAC Name: 1-(3-bromophenyl)-3-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]urea Traditional Name: 1-(3-bromophenyl)-3-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]urea Formula: C16H21BrN4O MolecularWeight: 365.26814

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CCNC(=O)NC2=CC(=CC=C2)Br)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CCNC(=O)NC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C16H21BrN4O/c1-4-21-12(3)15(11(2)20-21)8-9-18-16(22)19-14-7-5-6-13(17)10-14/h5-7,10H,4,8-9H2,1-3H3,(H2,18,19,22)