3-(1-benzofuran-2-yl)-5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-(1-benzofuran-2-yl)-5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-(benzofuran-2-yl)-5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-(2-benzofuranyl)-5-[(2-chlorophenyl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(1-benzofuran-2-yl)-5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(benzofuran-2-yl)-5-[(2-chlorobenzyl)thio]-4-methyl-1,2,4-triazole Formula: C18H14ClN3OS MolecularWeight: 355.84126

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2Cl)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2Cl)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C18H14ClN3OS/c1-22-17(16-10-12-6-3-5-9-15(12)23-16)20-21-18(22)24-11-13-7-2-4-8-14(13)19/h2-10H,11H2,1H3