3-methyl-N-[(2S)-5-methylhexan-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(2S)-5-methylhexan-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(1S)-1,4-dimethylpentyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(2S)-5-methylhexan-2-yl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(2S)-5-methylhexan-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: N-[(1S)-1,4-dimethylpentyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C17H23N3O2/c1-11(2)9-10-12(3)18-16(21)15-13-7-5-6-8-14(13)17(22)20(4)19-15/h5-8,11-12H,9-10H2,1-4H3,(H,18,21)/t12-/m0/s1