N-[1-[5-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide

Systemtic Name: N-[1-[5-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Openeye Name: N-[1-[5-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide CAS Name: N-[1-[5-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]-2-methylpropyl]benzamide IUPAC Name: N-[1-[5-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-methylpropyl]benzamide Traditional Name: N-[1-[5-[[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Formula: C23H25ClFN5O2S MolecularWeight: 489.993303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)Cl)C(C(C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)Cl)C(C(C)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25ClFN5O2S/c1-4-30-21(20(14(2)3)27-22(32)15-8-6-5-7-9-15)28-29-23(30)33-13-19(31)26-16-10-11-18(25)17(24)12-16/h5-12,14,20H,4,13H2,1-3H3,(H,26,31)(H,27,32)