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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-keto-1H-quinoline-4-carboxamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CC(C)C[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O2/c1-13(2)11-19(21-24-17-9-5-6-10-18(17)25-21)26-22(28)15-12-20(27)23-16-8-4-3-7-14(15)16/h3-10,12-13,19H,11H2,1-2H3,(H,23,27)(H,24,25)(H,26,28)/t19-/m0/s1