N-[(Z)-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[(Z)-[5-[(1S,2S)-2-methylcyclopropyl]-2-furyl]methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-[5-[(1S,2S)-2-methylcyclopropyl]-2-furanyl]methylideneamino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]methylideneamino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(Z)-[5-[(1S,2S)-2-methylcyclopropyl]-2-furyl]methyleneamino]phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=CC=C(O2)C=NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

Isomeric SMILES

C[C@H]1C[C@@H]1C2=CC=C(O2)/C=N\NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C21H22N4O3/c1-12(2)25-21(27)16-7-5-4-6-15(16)19(24-25)20(26)23-22-11-14-8-9-18(28-14)17-10-13(17)3/h4-9,11-13,17H,10H2,1-3H3,(H,23,26)/b22-11-/t13-,17-/m0/s1