1-tert-butyl-3-methylsulfanyl-1,2,4-triazole

Systemtic Name: 1-tert-butyl-3-methylsulfanyl-1,2,4-triazole Openeye Name: 1-tert-butyl-3-methylsulfanyl-1,2,4-triazole CAS Name: 1-tert-butyl-3-(methylthio)-1,2,4-triazole IUPAC Name: 1-tert-butyl-3-methylsulfanyl-1,2,4-triazole Traditional Name: 1-tert-butyl-3-(methylthio)-1,2,4-triazole Formula: C7H13N3S MolecularWeight: 171.26322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=NC(=N1)SC

Isomeric SMILES

CC(C)(C)N1C=NC(=N1)SC

InChI

InChI=1S/C7H13N3S/c1-7(2,3)10-5-8-6(9-10)11-4/h5H,1-4H3