3-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[[4-(dimethylamino)benzyl]-methyl-amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

InChI

InChI=1S/C21H23N5O3/c1-24(2)15-10-8-14(9-11-15)12-25(3)18(27)13-26-21(29)17-7-5-4-6-16(17)19(23-26)20(22)28/h4-11H,12-13H2,1-3H3,(H2,22,28)