3-[2-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[(1-benzylpyrazol-4-yl)methyl-methylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C23H22N6O3 MolecularWeight: 430.45918

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

InChI

InChI=1S/C23H22N6O3/c1-27(12-17-11-25-28(14-17)13-16-7-3-2-4-8-16)20(30)15-29-23(32)19-10-6-5-9-18(19)21(26-29)22(24)31/h2-11,14H,12-13,15H2,1H3,(H2,24,31)