N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(3,5-dimethylpyrazol-1-yl)ethanamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(3,5-dimethylpyrazol-1-yl)ethanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(3,5-dimethylpyrazol-1-yl)acetamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(3,5-dimethyl-1-pyrazolyl)acetamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(3,5-dimethylpyrazol-1-yl)acetamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(3,5-dimethylpyrazol-1-yl)acetamide Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NC(CCSC)C2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C18H23N5OS/c1-12-10-13(2)23(22-12)11-17(24)19-16(8-9-25-3)18-20-14-6-4-5-7-15(14)21-18/h4-7,10,16H,8-9,11H2,1-3H3,(H,19,24)(H,20,21)/t16-/m0/s1