N3-(4-bromophenyl)-N1-butyl-pyrazole-1,3-dicarboxamide

Systemtic Name: N3-(4-bromophenyl)-N1-butyl-pyrazole-1,3-dicarboxamide Openeye Name: N3-(4-bromophenyl)-N1-butyl-pyrazole-1,3-dicarboxamide CAS Name: N3-(4-bromophenyl)-N1-butylpyrazole-1,3-dicarboxamide IUPAC Name: 3-N-(4-bromophenyl)-1-N-butylpyrazole-1,3-dicarboxamide Traditional Name: N'-(4-bromophenyl)-N-butyl-pyrazole-1,3-dicarboxamide Formula: C15H17BrN4O2 MolecularWeight: 365.22508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1C=CC(=N1)C(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCNC(=O)N1C=CC(=N1)C(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H17BrN4O2/c1-2-3-9-17-15(22)20-10-8-13(19-20)14(21)18-12-6-4-11(16)5-7-12/h4-8,10H,2-3,9H2,1H3,(H,17,22)(H,18,21)