(3S)-3-[2-(1H-benzimidazol-2-yl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-[2-(1H-benzimidazol-2-yl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-[2-(1H-benzimidazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-[2-(1H-benzimidazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-[2-(1H-benzimidazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-[1-(1H-benzimidazol-2-yl)-5-keto-3-methyl-3-pyrazolin-4-yl]-1-(2-ethylphenyl)pyrrolidine-2,5-quinone Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)CC(C2=O)C3=C(NN(C3=O)C4=NC5=CC=CC=C5N4)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C[C@H](C2=O)C3=C(NN(C3=O)C4=NC5=CC=CC=C5N4)C

InChI

InChI=1S/C23H21N5O3/c1-3-14-8-4-7-11-18(14)27-19(29)12-15(21(27)30)20-13(2)26-28(22(20)31)23-24-16-9-5-6-10-17(16)25-23/h4-11,15,26H,3,12H2,1-2H3,(H,24,25)/t15-/m0/s1