3-tert-butyl-N,N-dimethyl-5-(2-oxidanylidenepropylsulfanyl)-1,2,4-triazole-1-carboxamide

Systemtic Name: 3-tert-butyl-N,N-dimethyl-5-(2-oxidanylidenepropylsulfanyl)-1,2,4-triazole-1-carboxamide Openeye Name: 5-acetonylsulfanyl-3-tert-butyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide CAS Name: 3-tert-butyl-N,N-dimethyl-5-(2-oxopropylthio)-1,2,4-triazole-1-carboxamide IUPAC Name: 3-tert-butyl-N,N-dimethyl-5-(2-oxopropylsulfanyl)-1,2,4-triazole-1-carboxamide Traditional Name: 5-(acetonylthio)-3-tert-butyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Formula: C12H20N4O2S MolecularWeight: 284.3778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC(=NN1C(=O)N(C)C)C(C)(C)C

Isomeric SMILES

CC(=O)CSC1=NC(=NN1C(=O)N(C)C)C(C)(C)C

InChI

InChI=1S/C12H20N4O2S/c1-8(17)7-19-10-13-9(12(2,3)4)14-16(10)11(18)15(5)6/h7H2,1-6H3