N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]-1-benzofuran-2-carboxamide Openeye Name: N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methyleneamino]benzofuran-2-carboxamide CAS Name: N-[(E)-[1-phenyl-3-(4-propoxyphenyl)-4-pyrazolyl]methylideneamino]-2-benzofurancarboxamide IUPAC Name: N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]-1-benzofuran-2-carboxamide Traditional Name: N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methyleneamino]coumarilamide Formula: C28H24N4O3 MolecularWeight: 464.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O3/c1-2-16-34-24-14-12-20(13-15-24)27-22(19-32(31-27)23-9-4-3-5-10-23)18-29-30-28(33)26-17-21-8-6-7-11-25(21)35-26/h3-15,17-19H,2,16H2,1H3,(H,30,33)/b29-18+