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

Systemtic Name: [3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-thiophen-2-yl-methanone Openeye Name: [3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-(2-thienyl)methanone CAS Name: [3-(4-chlorophenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-thiophen-2-ylmethanone IUPAC Name: [3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-thiophen-2-ylmethanone Traditional Name: [3-(4-chlorophenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-(2-thienyl)methanone Formula: C14H10ClN3OS2 MolecularWeight: 335.8317

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NN1C(=O)C2=CC=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC(=NN1C(=O)C2=CC=CS2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H10ClN3OS2/c1-20-14-16-12(9-4-6-10(15)7-5-9)17-18(14)13(19)11-3-2-8-21-11/h2-8H,1H3