N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-fluoro-benzothiophene-2-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-fluoro-benzothiophene-2-carboxamide Formula: C20H18FN3OS2 MolecularWeight: 399.504823

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C20H18FN3OS2/c1-26-10-9-16(19-22-14-6-2-3-7-15(14)23-19)24-20(25)18-11-12-13(21)5-4-8-17(12)27-18/h2-8,11,16H,9-10H2,1H3,(H,22,23)(H,24,25)/t16-/m0/s1