N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanamide Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetamide CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[2-[(methylthio)methyl]-1-benzimidazolyl]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetamide Traditional Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetamide Formula: C27H26N4OS MolecularWeight: 454.58654

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=CC=CC=C2N1CC(=O)NCC(C3=CC=CC=C3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CSCC1=NC2=CC=CC=C2N1CC(=O)NCC(C3=CC=CC=C3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H26N4OS/c1-33-18-26-30-24-13-7-8-14-25(24)31(26)17-27(32)29-15-21(19-9-3-2-4-10-19)22-16-28-23-12-6-5-11-20(22)23/h2-14,16,21,28H,15,17-18H2,1H3,(H,29,32)