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

Systemtic Name: 2-[[5-ethylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine Openeye Name: 2-[[5-ethylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine CAS Name: 2-[[5-(ethylthio)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methylthio]pyrimidine IUPAC Name: 2-[[5-ethylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine Traditional Name: 2-[[5-(ethylthio)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methylthio]pyrimidine Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)OC)CSC3=NC=CC=N3

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)OC)CSC3=NC=CC=N3

InChI

InChI=1S/C16H17N5OS2/c1-3-23-16-20-19-14(11-24-15-17-9-4-10-18-15)21(16)12-5-7-13(22-2)8-6-12/h4-10H,3,11H2,1-2H3