1-(4-bromophenyl)sulfonyl-3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazole

Systemtic Name: 1-(4-bromophenyl)sulfonyl-3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazole Openeye Name: 1-(4-bromophenyl)sulfonyl-3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 1-(4-bromophenyl)sulfonyl-3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazole IUPAC Name: 1-(4-bromophenyl)sulfonyl-3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazole Traditional Name: 1-brosyl-3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H20BrN3O4S/c1-3-4-13-27-19-21-18(14-5-9-16(26-2)10-6-14)23(22-19)28(24,25)17-11-7-15(20)8-12-17/h5-12H,3-4,13H2,1-2H3