N-[(Z)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C28H20N6O3 MolecularWeight: 488.4968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CN(N=C3C4=CC5=CC=CC=C5O4)C6=CC=CC=C6

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CN(N=C3C4=CC5=CC=CC=C5O4)C6=CC=CC=C6

InChI

InChI=1S/C28H20N6O3/c1-33-28(36)22-13-7-6-12-21(22)26(31-33)27(35)30-29-16-19-17-34(20-10-3-2-4-11-20)32-25(19)24-15-18-9-5-8-14-23(18)37-24/h2-17H,1H3,(H,30,35)/b29-16-