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

Systemtic Name: 2-[5-[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-N-(4-chlorophenyl)ethanamide Openeye Name: 2-[4-allyl-5-[2-(2,5-dichloroanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(4-chlorophenyl)acetamide CAS Name: N-(4-chlorophenyl)-2-[5-[[2-(2,5-dichloroanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[5-[2-(2,5-dichloroanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[4-allyl-5-[[2-(2,5-dichloroanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]-N-(4-chlorophenyl)acetamide Formula: C21H18Cl3N5O2S MolecularWeight: 510.82392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18Cl3N5O2S/c1-2-9-29-18(11-19(30)25-15-6-3-13(22)4-7-15)27-28-21(29)32-12-20(31)26-17-10-14(23)5-8-16(17)24/h2-8,10H,1,9,11-12H2,(H,25,30)(H,26,31)