N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(1R)-3-(2-furyl)-1-methyl-propyl]-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(2R)-4-(2-furanyl)butan-2-yl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[(1R)-3-(2-furyl)-1-methyl-propyl]-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C)CCC3=CC=CO3

Isomeric SMILES

C[C@H](CCC1=CC=CO1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C21H25N3O3/c1-14(2)13-24-21(26)18-9-5-4-8-17(18)19(23-24)20(25)22-15(3)10-11-16-7-6-12-27-16/h4-9,12,14-15H,10-11,13H2,1-3H3,(H,22,25)/t15-/m1/s1