[5-azanyl-3-(4-chlorophenyl)-1,2,4-triazol-1-yl]sulfanyl-methylsulfanyl-methanone

Systemtic Name: [5-azanyl-3-(4-chlorophenyl)-1,2,4-triazol-1-yl]sulfanyl-methylsulfanyl-methanone Openeye Name: [5-amino-3-(4-chlorophenyl)-1,2,4-triazol-1-yl]sulfanyl-methylsulfanyl-methanone CAS Name: [[5-amino-3-(4-chlorophenyl)-1,2,4-triazol-1-yl]thio]-(methylthio)methanone IUPAC Name: [5-amino-3-(4-chlorophenyl)-1,2,4-triazol-1-yl]sulfanyl-methylsulfanylmethanone Traditional Name: [[5-amino-3-(4-chlorophenyl)-1,2,4-triazol-1-yl]thio]-(methylthio)methanone Formula: C10H9ClN4OS2 MolecularWeight: 300.78766

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=O)SN1C(=NC(=N1)C2=CC=C(C=C2)Cl)N

Isomeric SMILES

CSC(=O)SN1C(=NC(=N1)C2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C10H9ClN4OS2/c1-17-10(16)18-15-9(12)13-8(14-15)6-2-4-7(11)5-3-6/h2-5H,1H3,(H2,12,13,14)