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

Systemtic Name: N-[[5-[2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-fluoranyl-benzamide Openeye Name: N-[[4-allyl-5-[2-(3,5-dichloroanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-fluoro-benzamide CAS Name: N-[[5-[[2-(3,5-dichloroanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide IUPAC Name: N-[[5-[2-(3,5-dichloroanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide Traditional Name: N-[[4-allyl-5-[[2-(3,5-dichloroanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]methyl]-2-fluoro-benzamide Formula: C21H18Cl2FN5O2S MolecularWeight: 494.369323

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=CC(=CC(=C2)Cl)Cl)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=CC(=CC(=C2)Cl)Cl)CNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H18Cl2FN5O2S/c1-2-7-29-18(11-25-20(31)16-5-3-4-6-17(16)24)27-28-21(29)32-12-19(30)26-15-9-13(22)8-14(23)10-15/h2-6,8-10H,1,7,11-12H2,(H,25,31)(H,26,30)