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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-(4-ethanoylphenyl)furan-2-carboxamide Openeye Name: 5-(4-acetylphenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]furan-2-carboxamide CAS Name: 5-(4-acetylphenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-furancarboxamide IUPAC Name: 5-(4-acetylphenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]furan-2-carboxamide Traditional Name: 5-(4-acetylphenyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-furamide Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)N[C@@H](CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H23N3O3S/c1-15(28)16-7-9-17(10-8-16)21-11-12-22(30-21)24(29)27-20(13-14-31-2)23-25-18-5-3-4-6-19(18)26-23/h3-12,20H,13-14H2,1-2H3,(H,25,26)(H,27,29)/t20-/m0/s1