N-heptan-2-yl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-heptan-2-yl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-methylhexyl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-heptan-2-yl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-heptan-2-yl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-methylhexyl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C19H28N4OS MolecularWeight: 360.51682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2C)C

Isomeric SMILES

CCCCCC(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2C)C

InChI

InChI=1S/C19H28N4OS/c1-5-6-7-11-15(3)20-18(24)13-25-19-22-21-16(4)23(19)17-12-9-8-10-14(17)2/h8-10,12,15H,5-7,11,13H2,1-4H3,(H,20,24)