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

Systemtic Name: N-butyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-butyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-butyl-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-butyl-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-butyl-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN(C=N1)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)CSC1=NN(C=N1)C2=CC=CC=C2

InChI

InChI=1S/C14H18N4OS/c1-2-3-9-15-13(19)10-20-14-16-11-18(17-14)12-7-5-4-6-8-12/h4-8,11H,2-3,9-10H2,1H3,(H,15,19)