N-[4-(4-methylphenoxy)phenyl]-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(4-methylphenoxy)phenyl]-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[4-(4-methylphenoxy)phenyl]-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-(4-methylphenoxy)phenyl]-2-[(4-pentyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[4-(4-methylphenoxy)phenyl]-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-amyl-1,2,4-triazol-3-yl)thio]-N-[4-(4-methylphenoxy)phenyl]acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN=C1SCC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCN1C=NN=C1SCC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N4O2S/c1-3-4-5-14-26-16-23-25-22(26)29-15-21(27)24-18-8-12-20(13-9-18)28-19-10-6-17(2)7-11-19/h6-13,16H,3-5,14-15H2,1-2H3,(H,24,27)