2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-[(3-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(3-fluorobenzyl)-N-methyl-acetamide Formula: C16H21FN4O2S MolecularWeight: 352.426943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)N(C)CC2=CC(=CC=C2)F

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)N(C)CC2=CC(=CC=C2)F

InChI

InChI=1S/C16H21FN4O2S/c1-3-4-8-21-15(23)18-19-16(21)24-11-14(22)20(2)10-12-6-5-7-13(17)9-12/h5-7,9H,3-4,8,10-11H2,1-2H3,(H,18,23)