3-tert-butyl-7-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-1H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-5-ium-4-one

Systemtic Name: 3-tert-butyl-7-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-1H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-5-ium-4-one Openeye Name: 3-tert-butyl-7-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-1H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-5-ium-4-one CAS Name: 3-tert-butyl-7-[(2-oxo-2-thiophen-2-ylethyl)thio]-1H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-5-ium-4-one IUPAC Name: 3-tert-butyl-7-(2-oxo-2-thiophen-2-ylethyl)sulfanyl-1H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-5-ium-4-one Traditional Name: 3-tert-butyl-7-[[2-keto-2-(2-thienyl)ethyl]thio]-1H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-5-ium-4-one Formula: C14H15N4O2S3+ MolecularWeight: 367.4895

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC2=[N+](C1=O)N=C(S2)SCC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=NNC2=[N+](C1=O)N=C(S2)SCC(=O)C3=CC=CS3

InChI

InChI=1S/C14H14N4O2S3/c1-14(2,3)10-11(20)18-12(16-15-10)23-13(17-18)22-7-8(19)9-5-4-6-21-9/h4-6H,7H2,1-3H3/p+1