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

Systemtic Name: 7-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Openeye Name: 7-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one CAS Name: 7-[(3,3-dimethyl-2-oxobutyl)thio]-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one IUPAC Name: 7-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Traditional Name: 7-[(2-keto-3,3-dimethyl-butyl)thio]-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O2S2/c1-16(2,3)11(21)9-23-15-19-20-13(22)12(17-18-14(20)24-15)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3