2-[[5-[[(3-chlorophenyl)amino]methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[[5-[[(3-chlorophenyl)amino]methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[[5-[(3-chloroanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[[5-[(3-chloroanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[[5-[(3-chloroanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[[5-[(3-chloroanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(2-methoxyphenyl)acetamide Formula: C20H22ClN5O2S MolecularWeight: 431.93898

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)CNC3=CC(=CC=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)CNC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN5O2S/c1-3-26-18(12-22-15-8-6-7-14(21)11-15)24-25-20(26)29-13-19(27)23-16-9-4-5-10-17(16)28-2/h4-11,22H,3,12-13H2,1-2H3,(H,23,27)