methyl 3-[[5-tert-butyl-2-(dimethylcarbamoyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methyl-propanoate

Systemtic Name: methyl 3-[[5-tert-butyl-2-(dimethylcarbamoyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methyl-propanoate Openeye Name: methyl 3-[[5-tert-butyl-2-(dimethylcarbamoyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methyl-propanoate CAS Name: 3-[[5-tert-butyl-2-[dimethylamino(oxo)methyl]-1,2,4-triazol-3-yl]thio]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-[[5-tert-butyl-2-(dimethylcarbamoyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methylpropanoate Traditional Name: 3-[[5-tert-butyl-2-(dimethylcarbamoyl)-1,2,4-triazol-3-yl]thio]-2-methyl-propionic acid methyl ester Formula: C14H24N4O3S MolecularWeight: 328.43036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N4O3S/c1-9(10(19)21-7)8-22-12-15-11(14(2,3)4)16-18(12)13(20)17(5)6/h9H,8H2,1-7H3