N-(3-chlorophenyl)-2-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-(3-chlorophenyl)-2-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(3-chlorophenyl)-2-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]acetamide CAS Name: N-(3-chlorophenyl)-2-[4-ethyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(3-chlorophenyl)-2-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]acetamide Traditional Name: N-(3-chlorophenyl)-2-[4-ethyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]acetamide Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCOC2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SCCOC2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN4O2S/c1-2-25-18(14-19(26)22-16-8-6-7-15(21)13-16)23-24-20(25)28-12-11-27-17-9-4-3-5-10-17/h3-10,13H,2,11-12,14H2,1H3,(H,22,26)