1-[(4-bromophenyl)methyl]-N-[(E)-furan-2-ylmethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(E)-furan-2-ylmethylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(E)-2-furylmethyleneamino]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(E)-2-furanylmethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(E)-furan-2-ylmethylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-2-furfurylideneamino]pyrazole-3-carboxamide Formula: C16H13BrN4O2 MolecularWeight: 373.20402

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=NNC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=COC(=C1)/C=N/NC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN4O2/c17-13-5-3-12(4-6-13)11-21-8-7-15(20-21)16(22)19-18-10-14-2-1-9-23-14/h1-10H,11H2,(H,19,22)/b18-10+