N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(4-fluorophenyl)furan-2-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(4-fluorophenyl)furan-2-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(4-fluorophenyl)furan-2-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-(4-fluorophenyl)-2-furancarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-(4-fluorophenyl)furan-2-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-(4-fluorophenyl)-2-furamide Formula: C22H20FN3O2S MolecularWeight: 409.476503

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)F

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O2S/c1-29-13-12-18(21-24-16-4-2-3-5-17(16)25-21)26-22(27)20-11-10-19(28-20)14-6-8-15(23)9-7-14/h2-11,18H,12-13H2,1H3,(H,24,25)(H,26,27)/t18-/m0/s1