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

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H23N5O2/c1-2-19-12-14-20(15-13-19)18-31-24(16-17-28-31)29-26(33)25-22-10-6-7-11-23(22)27(34)32(30-25)21-8-4-3-5-9-21/h3-17H,2,18H2,1H3,(H,29,33)