2,3,5-trimethyl-4-(1-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzenecarbothioamide

Systemtic Name: 2,3,5-trimethyl-4-(1-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzenecarbothioamide Openeye Name: 2,3,5-trimethyl-4-(1-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzenecarbothioamide CAS Name: 2,3,5-trimethyl-4-[1-methyl-5-(methylthio)-1,2,4-triazol-3-yl]benzenecarbothioamide IUPAC Name: 2,3,5-trimethyl-4-(1-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzenecarbothioamide Traditional Name: 2,3,5-trimethyl-4-[1-methyl-5-(methylthio)-1,2,4-triazol-3-yl]thiobenzamide Formula: C14H18N4S2 MolecularWeight: 306.44952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=S)N)C)C)C2=NN(C(=N2)SC)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=S)N)C)C)C2=NN(C(=N2)SC)C

InChI

InChI=1S/C14H18N4S2/c1-7-6-10(12(15)19)8(2)9(3)11(7)13-16-14(20-5)18(4)17-13/h6H,1-5H3,(H2,15,19)