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

Systemtic Name: 3-[(2-chlorophenyl)methyl]-7-(2-oxidanylidenepropylsulfanyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Openeye Name: 7-acetonylsulfanyl-3-[(2-chlorophenyl)methyl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-7-(2-oxopropylthio)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one IUPAC Name: 3-[(2-chlorophenyl)methyl]-7-(2-oxopropylsulfanyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Traditional Name: 7-(acetonylthio)-3-(2-chlorobenzyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one Formula: C14H11ClN4O2S2 MolecularWeight: 366.84574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN2C(=O)C(=NN=C2S1)CC3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)CSC1=NN2C(=O)C(=NN=C2S1)CC3=CC=CC=C3Cl

InChI

InChI=1S/C14H11ClN4O2S2/c1-8(20)7-22-14-18-19-12(21)11(16-17-13(19)23-14)6-9-4-2-3-5-10(9)15/h2-5H,6-7H2,1H3