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

Systemtic Name: 3-(4-methylphenyl)-7-(2-oxidanylidenepropylsulfanyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Openeye Name: 7-acetonylsulfanyl-3-(p-tolyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one CAS Name: 3-(4-methylphenyl)-7-(2-oxopropylthio)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one IUPAC Name: 3-(4-methylphenyl)-7-(2-oxopropylsulfanyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Traditional Name: 7-(acetonylthio)-3-(p-tolyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Formula: C14H12N4O2S2 MolecularWeight: 332.40068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C3N(C2=O)N=C(S3)SCC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C3N(C2=O)N=C(S3)SCC(=O)C

InChI

InChI=1S/C14H12N4O2S2/c1-8-3-5-10(6-4-8)11-12(20)18-13(16-15-11)22-14(17-18)21-7-9(2)19/h3-6H,7H2,1-2H3