3-[2-[[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[[2-(2,3-dimethylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[[2-(2,3-dimethylanilino)-2-keto-ethyl]amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)C

InChI

InChI=1S/C21H21N5O4/c1-12-6-5-9-16(13(12)2)24-17(27)10-23-18(28)11-26-21(30)15-8-4-3-7-14(15)19(25-26)20(22)29/h3-9H,10-11H2,1-2H3,(H2,22,29)(H,23,28)(H,24,27)