N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(=O)NCC3=CC=CO3

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H22N4O4/c1-13(2)12-24-20(27)16-8-4-3-7-15(16)18(23-24)19(26)22-11-17(25)21-10-14-6-5-9-28-14/h3-9,13H,10-12H2,1-2H3,(H,21,25)(H,22,26)