N-[2-(3-fluorophenyl)ethyl]-2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-[2-(3-fluorophenyl)ethyl]-2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[2-(3-fluorophenyl)ethyl]-2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[2-(3-fluorophenyl)ethyl]-2-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[2-(3-fluorophenyl)ethyl]-2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-[2-(3-fluorophenyl)ethyl]-2-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC(=CC=C3)F

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC(=CC=C3)F

InChI

InChI=1S/C21H21FN4O2S/c1-26-12-11-24-21(26)29-14-19(27)25-18-8-3-2-7-17(18)20(28)23-10-9-15-5-4-6-16(22)13-15/h2-8,11-13H,9-10,14H2,1H3,(H,23,28)(H,25,27)