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

Systemtic Name: N-[(E)-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]pyrazine-2-carboxamide Openeye Name: N-[(E)-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]pyrazine-2-carboxamide CAS Name: N-[(E)-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-pyrazinecarboxamide IUPAC Name: N-[(E)-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]pyrazine-2-carboxamide Traditional Name: N-[(E)-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]pyrazinamide Formula: C22H18N6O2 MolecularWeight: 398.41732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)C3=NC=CN=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)C3=NC=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N6O2/c1-30-19-9-7-16(8-10-19)21-17(15-28(27-21)18-5-3-2-4-6-18)13-25-26-22(29)20-14-23-11-12-24-20/h2-15H,1H3,(H,26,29)/b25-13+