3-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoyl-(4-fluorophenyl)amino]propanamide

Systemtic Name: 3-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoyl-(4-fluorophenyl)amino]propanamide Openeye Name: 3-(N-[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]-4-fluoro-anilino)propanamide CAS Name: 3-(N-[2-[(1-ethyl-2-benzimidazolyl)thio]-1-oxoethyl]-4-fluoroanilino)propanamide IUPAC Name: 3-(N-[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]-4-fluoroanilino)propanamide Traditional Name: 3-(N-[2-[(1-ethylbenzimidazol-2-yl)thio]acetyl]-4-fluoro-anilino)propionamide Formula: C20H21FN4O2S MolecularWeight: 400.469743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4O2S/c1-2-24-17-6-4-3-5-16(17)23-20(24)28-13-19(27)25(12-11-18(22)26)15-9-7-14(21)8-10-15/h3-10H,2,11-13H2,1H3,(H2,22,26)