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

Systemtic Name: 2-[(3-butylsulfanyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]-4,6-dimethyl-pyrimidine Openeye Name: 2-[(3-butylsulfanyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]-4,6-dimethyl-pyrimidine CAS Name: 2-[[3-(butylthio)-1H-1,2,4-triazol-5-yl]methylthio]-4,6-dimethylpyrimidine IUPAC Name: 2-[(3-butylsulfanyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]-4,6-dimethylpyrimidine Traditional Name: 2-[[3-(butylthio)-1H-1,2,4-triazol-5-yl]methylthio]-4,6-dimethyl-pyrimidine Formula: C13H19N5S2 MolecularWeight: 309.45346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NNC(=N1)CSC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCCCSC1=NNC(=N1)CSC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C13H19N5S2/c1-4-5-6-19-13-16-11(17-18-13)8-20-12-14-9(2)7-10(3)15-12/h7H,4-6,8H2,1-3H3,(H,16,17,18)