N-[4-chloranyl-2-(trifluoromethyl)phenyl]-2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-chloranyl-2-(trifluoromethyl)phenyl]-2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide CAS Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide Formula: C21H18ClF3N4OS MolecularWeight: 466.90703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=C(C=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=C(C=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C21H18ClF3N4OS/c1-3-9-29-19(14-6-4-5-13(2)10-14)27-28-20(29)31-12-18(30)26-17-8-7-15(22)11-16(17)21(23,24)25/h3-8,10-11H,1,9,12H2,2H3,(H,26,30)