N-[1-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-2-methoxy-benzamide

Systemtic Name: N-[1-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-2-methoxy-benzamide Openeye Name: N-[1-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-methoxy-benzamide CAS Name: N-[1-[4-ethyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]-2-hydroxyethyl]-2-methoxybenzamide IUPAC Name: N-[1-[4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]-2-hydroxyethyl]-2-methoxybenzamide Traditional Name: N-[1-[4-ethyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-methoxy-benzamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCOC2=CC=CC=C2)C(CO)NC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CCN1C(=NN=C1SCCOC2=CC=CC=C2)C(CO)NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C22H26N4O4S/c1-3-26-20(18(15-27)23-21(28)17-11-7-8-12-19(17)29-2)24-25-22(26)31-14-13-30-16-9-5-4-6-10-16/h4-12,18,27H,3,13-15H2,1-2H3,(H,23,28)