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

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-2-[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-[4-allyl-5-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(2,3-dichlorophenyl)acetamide CAS Name: N-(2,3-dichlorophenyl)-2-[5-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(2,3-dichlorophenyl)-2-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[4-allyl-5-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]-N-(2,3-dichlorophenyl)acetamide Formula: C21H18Cl2FN5O2S MolecularWeight: 494.369323

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)CC(=O)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)CC(=O)NC3=C(C(=CC=C3)Cl)Cl

InChI

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