3-ethyl-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-ethyl-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-4-keto-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]phthalazine-1-carboxamide Formula: C26H27N7O2 MolecularWeight: 469.53828

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=C(N(N=C3C)C4=CC=CC=C4)N5CCCC5

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=C(N(N=C3C)C4=CC=CC=C4)N5CCCC5

InChI

InChI=1S/C26H27N7O2/c1-3-32-26(35)21-14-8-7-13-20(21)23(30-32)24(34)28-27-17-22-18(2)29-33(19-11-5-4-6-12-19)25(22)31-15-9-10-16-31/h4-8,11-14,17H,3,9-10,15-16H2,1-2H3,(H,28,34)/b27-17+