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

Systemtic Name: 5-(1-benzofuran-2-yl)-3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(benzofuran-2-yl)-3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-benzofuranyl)-3-[(4-chlorophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(1-benzofuran-2-yl)-3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(benzofuran-2-yl)-3-[(4-chlorobenzyl)thio]-1H-1,2,4-triazole Formula: C17H12ClN3OS MolecularWeight: 341.81468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C3=NC(=NN3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C3=NC(=NN3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H12ClN3OS/c18-13-7-5-11(6-8-13)10-23-17-19-16(20-21-17)15-9-12-3-1-2-4-14(12)22-15/h1-9H,10H2,(H,19,20,21)