5-(4-bromanyl-5-chloranyl-thiophen-2-yl)-2-(5-chloranyl-2-oxidanyl-phenyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 5-(4-bromanyl-5-chloranyl-thiophen-2-yl)-2-(5-chloranyl-2-oxidanyl-phenyl)-1H-1,2,4-triazol-3-one Openeye Name: 5-(4-bromo-5-chloro-2-thienyl)-2-(5-chloro-2-hydroxy-phenyl)-1H-1,2,4-triazol-3-one CAS Name: 5-(4-bromo-5-chloro-2-thiophenyl)-2-(5-chloro-2-hydroxyphenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 5-(4-bromo-5-chlorothiophen-2-yl)-2-(5-chloro-2-hydroxyphenyl)-1H-1,2,4-triazol-3-one Traditional Name: 5-(4-bromo-5-chloro-2-thienyl)-2-(5-chloro-2-hydroxy-phenyl)-1H-1,2,4-triazol-3-one Formula: C12H6BrCl2N3O2S MolecularWeight: 407.06994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)N2C(=O)N=C(N2)C3=CC(=C(S3)Cl)Br)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)N2C(=O)N=C(N2)C3=CC(=C(S3)Cl)Br)O

InChI

InChI=1S/C12H6BrCl2N3O2S/c13-6-4-9(21-10(6)15)11-16-12(20)18(17-11)7-3-5(14)1-2-8(7)19/h1-4,19H,(H,16,17,20)