N-[(1R)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC2=CC=CC=C2N1)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)[C@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H19N5O2/c1-11(2)16(18-21-14-9-5-6-10-15(14)22-18)23-20(27)17-12-7-3-4-8-13(12)19(26)25-24-17/h3-11,16H,1-2H3,(H,21,22)(H,23,27)(H,25,26)/t16-/m1/s1