3-[[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-amino]methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-amino]methyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-amino]methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]methyl-methylamino]methyl]-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl-methylamino]methyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-[[[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-amino]methyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C25H27ClN6O2 MolecularWeight: 478.97388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)CN(C)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)NC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)CN(C)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)NC

InChI

InChI=1S/C25H27ClN6O2/c1-16-21(17(2)31(28-16)13-18-9-5-8-12-22(18)26)14-30(4)15-32-25(34)20-11-7-6-10-19(20)23(29-32)24(33)27-3/h5-12H,13-15H2,1-4H3,(H,27,33)