2-[[5-[(2,5-dimethylphenoxy)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[5-[(2,5-dimethylphenoxy)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[5-[(2,5-dimethylphenoxy)methyl]-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[5-[(2,5-dimethylphenoxy)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[5-[(2,5-dimethylphenoxy)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[5-[(2,5-dimethylphenoxy)methyl]-4-isopropyl-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC2=NN=C(N2C(C)C)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC2=NN=C(N2C(C)C)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-15(2)26-20(13-28-19-12-16(3)10-11-17(19)4)24-25-22(26)29-14-21(27)23-18-8-6-5-7-9-18/h5-12,15H,13-14H2,1-4H3,(H,23,27)