7-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-(4-fluorophenyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

Systemtic Name: 7-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-(4-fluorophenyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Openeye Name: 7-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-(4-fluorophenyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one CAS Name: 7-[(3,3-dimethyl-2-oxobutyl)thio]-3-(4-fluorophenyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one IUPAC Name: 7-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-(4-fluorophenyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Traditional Name: 3-(4-fluorophenyl)-7-[(2-keto-3,3-dimethyl-butyl)thio]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Formula: C16H15FN4O2S2 MolecularWeight: 378.444303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN2C(=O)C(=NN=C2S1)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN2C(=O)C(=NN=C2S1)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H15FN4O2S2/c1-16(2,3)11(22)8-24-15-20-21-13(23)12(18-19-14(21)25-15)9-4-6-10(17)7-5-9/h4-7H,8H2,1-3H3