2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynyl-acetamide CAS Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-prop-2-ynylacetamide IUPAC Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-ynylacetamide Traditional Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-propargyl-acetamide Formula: C15H16N4O2S MolecularWeight: 316.37814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NCC#C)C2=CC=CC=C2OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NCC#C)C2=CC=CC=C2OC

InChI

InChI=1S/C15H16N4O2S/c1-4-9-16-13(20)10-22-15-18-17-14(19(15)2)11-7-5-6-8-12(11)21-3/h1,5-8H,9-10H2,2-3H3,(H,16,20)