7-(2-oxidanylidenepropylsulfanyl)-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

Systemtic Name: 7-(2-oxidanylidenepropylsulfanyl)-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Openeye Name: 7-acetonylsulfanyl-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one CAS Name: 7-(2-oxopropylthio)-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one IUPAC Name: 7-(2-oxopropylsulfanyl)-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Traditional Name: 7-(acetonylthio)-3-phenyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Formula: C13H10N4O2S2 MolecularWeight: 318.3741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4O2S2/c1-8(18)7-20-13-16-17-11(19)10(14-15-12(17)21-13)9-5-3-2-4-6-9/h2-6H,7H2,1H3