2-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine

Systemtic Name: 2-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine Openeye Name: 2-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine CAS Name: 2-[[4-(4-methoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methylthio]pyrimidine IUPAC Name: 2-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine Traditional Name: 2-[[4-(4-methoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methylthio]pyrimidine Formula: C17H19N5OS2 MolecularWeight: 373.49566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=C(C=C2)OC)CSC3=NC=CC=N3

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=C(C=C2)OC)CSC3=NC=CC=N3

InChI

InChI=1S/C17H19N5OS2/c1-3-11-24-17-21-20-15(12-25-16-18-9-4-10-19-16)22(17)13-5-7-14(23-2)8-6-13/h4-10H,3,11-12H2,1-2H3