N-(5-fluoranyl-2-methyl-phenyl)-2-[[5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-fluoranyl-2-methyl-phenyl)-2-[[5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(5-fluoro-2-methyl-phenyl)-2-[[5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-fluoro-2-methylphenyl)-2-[[5-[(2-methoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-fluoro-2-methylphenyl)-2-[[5-[(2-methoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(5-fluoro-2-methyl-phenyl)-2-[[5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H23FN4O3S MolecularWeight: 430.495723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN4O3S/c1-13-5-8-17(18(9-13)28-4)29-11-19-24-25-21(26(19)3)30-12-20(27)23-16-10-15(22)7-6-14(16)2/h5-10H,11-12H2,1-4H3,(H,23,27)