5-bromanyl-N-[(E)-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(E)-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]furan-2-carboxamide Openeye Name: 5-bromo-N-[(E)-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]methyleneamino]furan-2-carboxamide CAS Name: 5-bromo-N-[(E)-[3-(3-methylphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(E)-[3-(3-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]furan-2-carboxamide Traditional Name: 5-bromo-N-[(E)-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-furamide Formula: C22H17BrN4O2 MolecularWeight: 449.29998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C=NNC(=O)C3=CC=C(O3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2/C=N/NC(=O)C3=CC=C(O3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H17BrN4O2/c1-15-6-5-7-16(12-15)21-17(14-27(26-21)18-8-3-2-4-9-18)13-24-25-22(28)19-10-11-20(23)29-19/h2-14H,1H3,(H,25,28)/b24-13+