N-(3-chloranyl-2-methyl-phenyl)-2-[[4-ethyl-5-[[(4-methylphenyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[[4-ethyl-5-[[(4-methylphenyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[[4-ethyl-5-[(4-methylanilino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[4-ethyl-5-[(4-methylanilino)methyl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[[4-ethyl-5-[(4-methylanilino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[4-ethyl-5-(p-toluidinomethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H24ClN5OS MolecularWeight: 429.96616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C(=CC=C2)Cl)C)CNC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C(=CC=C2)Cl)C)CNC3=CC=C(C=C3)C

InChI

InChI=1S/C21H24ClN5OS/c1-4-27-19(12-23-16-10-8-14(2)9-11-16)25-26-21(27)29-13-20(28)24-18-7-5-6-17(22)15(18)3/h5-11,23H,4,12-13H2,1-3H3,(H,24,28)