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

Systemtic Name: 2-[(5-butan-2-ylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methylsulfanyl]-4,6-dimethyl-pyrimidine Openeye Name: 4,6-dimethyl-2-[(4-methyl-5-sec-butylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]pyrimidine CAS Name: 2-[[5-(butan-2-ylthio)-4-methyl-1,2,4-triazol-3-yl]methylthio]-4,6-dimethylpyrimidine IUPAC Name: 2-[(5-butan-2-ylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methylsulfanyl]-4,6-dimethylpyrimidine Traditional Name: 4,6-dimethyl-2-[[4-methyl-5-(sec-butylthio)-1,2,4-triazol-3-yl]methylthio]pyrimidine Formula: C14H21N5S2 MolecularWeight: 323.48004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(N1C)CSC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCC(C)SC1=NN=C(N1C)CSC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C14H21N5S2/c1-6-11(4)21-14-18-17-12(19(14)5)8-20-13-15-9(2)7-10(3)16-13/h7,11H,6,8H2,1-5H3