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

Systemtic Name: 5-(5-bromanylthiophen-2-yl)-2-(5-chloranyl-2-methoxy-4-methyl-phenyl)-1H-1,2,4-triazol-3-one Openeye Name: 5-(5-bromo-2-thienyl)-2-(5-chloro-2-methoxy-4-methyl-phenyl)-1H-1,2,4-triazol-3-one CAS Name: 5-(5-bromo-2-thiophenyl)-2-(5-chloro-2-methoxy-4-methylphenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 5-(5-bromothiophen-2-yl)-2-(5-chloro-2-methoxy-4-methylphenyl)-1H-1,2,4-triazol-3-one Traditional Name: 5-(5-bromo-2-thienyl)-2-(5-chloro-2-methoxy-4-methyl-phenyl)-1H-1,2,4-triazol-3-one Formula: C14H11BrClN3O2S MolecularWeight: 400.67804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)N2C(=O)N=C(N2)C3=CC=C(S3)Br)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)N2C(=O)N=C(N2)C3=CC=C(S3)Br)OC

InChI

InChI=1S/C14H11BrClN3O2S/c1-7-5-10(21-2)9(6-8(7)16)19-14(20)17-13(18-19)11-3-4-12(15)22-11/h3-6H,1-2H3,(H,17,18,20)