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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-2-keto-1H-quinoline-4-carboxamide Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O2/c1-12(2)19(20-23-16-9-5-6-10-17(16)24-20)25-21(27)14-11-18(26)22-15-8-4-3-7-13(14)15/h3-12,19H,1-2H3,(H,22,26)(H,23,24)(H,25,27)/t19-/m0/s1