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

Systemtic Name: N-hexyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-hexyl-acetamide CAS Name: N-hexyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-hexylacetamide Traditional Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-hexyl-acetamide Formula: C18H26N4OS MolecularWeight: 346.49024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C

Isomeric SMILES

CCCCCCNC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C

InChI

InChI=1S/C18H26N4OS/c1-3-4-5-9-12-19-17(23)14-24-18-21-20-15(2)22(18)13-16-10-7-6-8-11-16/h6-8,10-11H,3-5,9,12-14H2,1-2H3,(H,19,23)