N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(furan-2-ylmethyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(furan-2-ylmethyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-(2-furylmethyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(2-furanylmethyl)-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(furan-2-ylmethyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-(2-furfuryl)-4-keto-3H-phthalazine-1-carboxamide Formula: C22H22N6O5 MolecularWeight: 450.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)C3=NNC(=O)C4=CC=CC=C43)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)C3=NNC(=O)C4=CC=CC=C43)N

InChI

InChI=1S/C22H22N6O5/c1-2-3-10-27-18(23)17(20(30)24-22(27)32)28(12-13-7-6-11-33-13)21(31)16-14-8-4-5-9-15(14)19(29)26-25-16/h4-9,11H,2-3,10,12,23H2,1H3,(H,26,29)(H,24,30,32)