4-(5-chloranyl-2-methoxy-phenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(5-chloranyl-2-methoxy-phenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(5-chloro-2-methoxy-phenyl)-3-(2-furyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(5-chloro-2-methoxyphenyl)-3-(2-furanyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(5-chloro-2-methoxyphenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(5-chloro-2-methoxy-phenyl)-3-(2-furyl)-1H-1,2,4-triazole-5-thione Formula: C13H10ClN3O2S MolecularWeight: 307.7554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)C3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)C3=CC=CO3

InChI

InChI=1S/C13H10ClN3O2S/c1-18-10-5-4-8(14)7-9(10)17-12(15-16-13(17)20)11-3-2-6-19-11/h2-7H,1H3,(H,16,20)