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

Systemtic Name: 5-(5-bromanylthiophen-2-yl)-2-(5-chloranyl-3-methyl-2-oxidanyl-phenyl)-1H-1,2,4-triazol-3-one Openeye Name: 5-(5-bromo-2-thienyl)-2-(5-chloro-2-hydroxy-3-methyl-phenyl)-1H-1,2,4-triazol-3-one CAS Name: 5-(5-bromo-2-thiophenyl)-2-(5-chloro-2-hydroxy-3-methylphenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 5-(5-bromothiophen-2-yl)-2-(5-chloro-2-hydroxy-3-methylphenyl)-1H-1,2,4-triazol-3-one Traditional Name: 5-(5-bromo-2-thienyl)-2-(5-chloro-2-hydroxy-3-methyl-phenyl)-1H-1,2,4-triazol-3-one Formula: C13H9BrClN3O2S MolecularWeight: 386.65146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)N2C(=O)N=C(N2)C3=CC=C(S3)Br)Cl

Isomeric SMILES

CC1=CC(=CC(=C1O)N2C(=O)N=C(N2)C3=CC=C(S3)Br)Cl

InChI

InChI=1S/C13H9BrClN3O2S/c1-6-4-7(15)5-8(11(6)19)18-13(20)16-12(17-18)9-2-3-10(14)21-9/h2-5,19H,1H3,(H,16,17,20)