2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[4-methyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]-1-phenylethanone IUPAC Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]-1-phenyl-ethanone Formula: C15H13N5OS MolecularWeight: 311.36162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C3=NC=CN=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C3=NC=CN=C3

InChI

InChI=1S/C15H13N5OS/c1-20-14(12-9-16-7-8-17-12)18-19-15(20)22-10-13(21)11-5-3-2-4-6-11/h2-9H,10H2,1H3