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

Systemtic Name: N-tert-butyl-2-[[4-butyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(5-benzyl-4-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[[4-butyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(5-benzyl-4-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butylacetamide Traditional Name: 2-[(5-benzyl-4-butyl-1,2,4-triazol-3-yl)thio]-N-tert-butyl-acetamide Formula: C19H28N4OS MolecularWeight: 360.51682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SCC(=O)NC(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=NN=C1SCC(=O)NC(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C19H28N4OS/c1-5-6-12-23-16(13-15-10-8-7-9-11-15)21-22-18(23)25-14-17(24)20-19(2,3)4/h7-11H,5-6,12-14H2,1-4H3,(H,20,24)