3-[2,6-bis(chloranyl)phenyl]-1-methyl-5-[3,4,5-tris(chloranyl)thiophen-2-yl]-1,2,4-triazole

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-1-methyl-5-[3,4,5-tris(chloranyl)thiophen-2-yl]-1,2,4-triazole Openeye Name: 3-(2,6-dichlorophenyl)-1-methyl-5-(3,4,5-trichloro-2-thienyl)-1,2,4-triazole CAS Name: 3-(2,6-dichlorophenyl)-1-methyl-5-(3,4,5-trichloro-2-thiophenyl)-1,2,4-triazole IUPAC Name: 3-(2,6-dichlorophenyl)-1-methyl-5-(3,4,5-trichlorothiophen-2-yl)-1,2,4-triazole Traditional Name: 3-(2,6-dichlorophenyl)-1-methyl-5-(3,4,5-trichloro-2-thienyl)-1,2,4-triazole Formula: C13H6Cl5N3S MolecularWeight: 413.53684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)C2=C(C=CC=C2Cl)Cl)C3=C(C(=C(S3)Cl)Cl)Cl

Isomeric SMILES

CN1C(=NC(=N1)C2=C(C=CC=C2Cl)Cl)C3=C(C(=C(S3)Cl)Cl)Cl

InChI

InChI=1S/C13H6Cl5N3S/c1-21-13(10-8(16)9(17)11(18)22-10)19-12(20-21)7-5(14)3-2-4-6(7)15/h2-4H,1H3