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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O2/c1-12(2)17(19-22-15-10-6-7-11-16(15)23-19)24-20(27)18-13-8-4-5-9-14(13)21(28)26(3)25-18/h4-12,17H,1-3H3,(H,22,23)(H,24,27)/t17-/m0/s1