2-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoyl-methyl-amino]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoyl-methyl-amino]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]-methyl-amino]-N-(4-fluorophenyl)acetamide CAS Name: 2-[[2-[(1-ethyl-2-benzimidazolyl)thio]-1-oxoethyl]-methylamino]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]-methylamino]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[2-[(1-ethylbenzimidazol-2-yl)thio]acetyl]-methyl-amino]-N-(4-fluorophenyl)acetamide Formula: C20H21FN4O2S MolecularWeight: 400.469743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)N(C)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)N(C)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4O2S/c1-3-25-17-7-5-4-6-16(17)23-20(25)28-13-19(27)24(2)12-18(26)22-15-10-8-14(21)9-11-15/h4-11H,3,12-13H2,1-2H3,(H,22,26)