3,3-dimethyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)butan-2-one

Systemtic Name: 3,3-dimethyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)butan-2-one Openeye Name: 3,3-dimethyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)butan-2-one CAS Name: 3,3-dimethyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)-2-butanone IUPAC Name: 3,3-dimethyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)butan-2-one Traditional Name: 3,3-dimethyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)butan-2-one Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C2N1C=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C2N1C=CC=C2

InChI

InChI=1S/C12H15N3OS/c1-12(2,3)9(16)8-17-11-14-13-10-6-4-5-7-15(10)11/h4-7H,8H2,1-3H3