3-[2-[[5-(4-bromophenyl)furan-2-yl]methyl-methyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[[5-(4-bromophenyl)furan-2-yl]methyl-methyl-amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[[5-(4-bromophenyl)-2-furyl]methyl-methyl-amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[[5-(4-bromophenyl)-2-furanyl]methyl-methylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[[5-(4-bromophenyl)furan-2-yl]methyl-methylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[[5-(4-bromophenyl)-2-furyl]methyl-methyl-amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C23H19BrN4O4 MolecularWeight: 495.32536

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(O1)C2=CC=C(C=C2)Br)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

Isomeric SMILES

CN(CC1=CC=C(O1)C2=CC=C(C=C2)Br)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N

InChI

InChI=1S/C23H19BrN4O4/c1-27(12-16-10-11-19(32-16)14-6-8-15(24)9-7-14)20(29)13-28-23(31)18-5-3-2-4-17(18)21(26-28)22(25)30/h2-11H,12-13H2,1H3,(H2,25,30)