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

Systemtic Name: N-butyl-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-butyl-acetamide CAS Name: N-butyl-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-butylacetamide Traditional Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-butyl-acetamide Formula: C17H24N4OS MolecularWeight: 332.46366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN=C(N1CC)CC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)CSC1=NN=C(N1CC)CC2=CC=CC=C2

InChI

InChI=1S/C17H24N4OS/c1-3-5-11-18-16(22)13-23-17-20-19-15(21(17)4-2)12-14-9-7-6-8-10-14/h6-10H,3-5,11-13H2,1-2H3,(H,18,22)