N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(5-bromanyl-2-methyl-1H-indol-3-yl)ethanamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(5-bromanyl-2-methyl-1H-indol-3-yl)ethanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(5-bromo-2-methyl-1H-indol-3-yl)acetamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(5-bromo-2-methyl-1H-indol-3-yl)acetamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(5-bromo-2-methyl-1H-indol-3-yl)acetamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(5-bromo-2-methyl-1H-indol-3-yl)acetamide Formula: C22H23BrN4OS MolecularWeight: 471.41322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)Br)CC(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)Br)CC(=O)N[C@@H](CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H23BrN4OS/c1-13-15(16-11-14(23)7-8-17(16)24-13)12-21(28)25-20(9-10-29-2)22-26-18-5-3-4-6-19(18)27-22/h3-8,11,20,24H,9-10,12H2,1-2H3,(H,25,28)(H,26,27)/t20-/m0/s1