N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C23H25N5OS MolecularWeight: 419.5425

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N5OS/c1-30-14-13-21(23-26-19-9-5-6-10-20(19)27-23)25-22(29)12-11-17-15-24-28(16-17)18-7-3-2-4-8-18/h2-10,15-16,21H,11-14H2,1H3,(H,25,29)(H,26,27)