1-(4-bromophenyl)sulfonyl-3-methoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole

Systemtic Name: 1-(4-bromophenyl)sulfonyl-3-methoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole Openeye Name: 1-(4-bromophenyl)sulfonyl-3-methoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole CAS Name: 1-(4-bromophenyl)sulfonyl-3-methoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole IUPAC Name: 1-(4-bromophenyl)sulfonyl-3-methoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole Traditional Name: 1-brosyl-3-methoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazole Formula: C18H18BrN3O6S MolecularWeight: 484.32102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC(=NN2S(=O)(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC(=NN2S(=O)(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C18H18BrN3O6S/c1-25-14-9-11(10-15(26-2)16(14)27-3)17-20-18(28-4)21-22(17)29(23,24)13-7-5-12(19)6-8-13/h5-10H,1-4H3