3-[[4-methyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[[4-methyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[[4-methyl-5-(3-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one CAS Name: 3-[[4-methyl-5-(3-pyridinylmethylthio)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[[4-methyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Traditional Name: 3-[[4-methyl-5-(3-pyridylmethylthio)-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one Formula: C17H15N5OS2 MolecularWeight: 369.4639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CN=CC=C2)CN3C4=CC=CC=C4SC3=O

Isomeric SMILES

CN1C(=NN=C1SCC2=CN=CC=C2)CN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C17H15N5OS2/c1-21-15(10-22-13-6-2-3-7-14(13)25-17(22)23)19-20-16(21)24-11-12-5-4-8-18-9-12/h2-9H,10-11H2,1H3