3-(5-chloranyl-3-methyl-1-benzofuran-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-chloranyl-3-methyl-1-benzofuran-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-chloro-3-methyl-benzofuran-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-chloro-3-methyl-2-benzofuranyl)-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-chloro-3-methyl-1-benzofuran-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-chloro-3-methyl-benzofuran-2-yl)-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C17H12ClN3OS MolecularWeight: 341.81468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Cl)C3=NNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Cl)C3=NNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C17H12ClN3OS/c1-10-13-9-11(18)7-8-14(13)22-15(10)16-19-20-17(23)21(16)12-5-3-2-4-6-12/h2-9H,1H3,(H,20,23)