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

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-butyl-ethanamide Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-butyl-acetamide CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-butylacetamide IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-butylacetamide Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-butyl-acetamide Formula: C12H23N5OS MolecularWeight: 285.40892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)NCCCC

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)NCCCC

InChI

InChI=1S/C12H23N5OS/c1-3-5-7-10-15-16-12(17(10)13)19-9-11(18)14-8-6-4-2/h3-9,13H2,1-2H3,(H,14,18)