2-phenyl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: 2-phenyl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-acetamide CAS Name: 2-phenyl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: 2-phenyl-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-2-phenyl-acetamide Formula: C13H14N4OS MolecularWeight: 274.34146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN=C1SC(C2=CC=CC=C2)C(=O)N

Isomeric SMILES

C=CCN1C=NN=C1SC(C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C13H14N4OS/c1-2-8-17-9-15-16-13(17)19-11(12(14)18)10-6-4-3-5-7-10/h2-7,9,11H,1,8H2,(H2,14,18)