4,6-dimethyl-2-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methylsulfanyl]pyrimidine

Systemtic Name: 4,6-dimethyl-2-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methylsulfanyl]pyrimidine Openeye Name: 4,6-dimethyl-2-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methylsulfanyl]pyrimidine CAS Name: 4,6-dimethyl-2-[[5-(methylthio)-4-phenyl-1,2,4-triazol-3-yl]methylthio]pyrimidine IUPAC Name: 4,6-dimethyl-2-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methylsulfanyl]pyrimidine Traditional Name: 4,6-dimethyl-2-[[5-(methylthio)-4-phenyl-1,2,4-triazol-3-yl]methylthio]pyrimidine Formula: C16H17N5S2 MolecularWeight: 343.46968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NN=C(N2C3=CC=CC=C3)SC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NN=C(N2C3=CC=CC=C3)SC)C

InChI

InChI=1S/C16H17N5S2/c1-11-9-12(2)18-15(17-11)23-10-14-19-20-16(22-3)21(14)13-7-5-4-6-8-13/h4-9H,10H2,1-3H3