5-bromanyl-N-(2,5-dimethoxyphenyl)-2-ethylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-(2,5-dimethoxyphenyl)-2-ethylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(2,5-dimethoxyphenyl)-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(2,5-dimethoxyphenyl)-2-ethylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-(2,5-dimethoxyphenyl)-2-ethylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-(2,5-dimethoxyphenyl)-2-esyl-pyrimidine-4-carboxamide Formula: C15H16BrN3O5S MolecularWeight: 430.27364

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C=CC(=C2)OC)OC)Br

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C=CC(=C2)OC)OC)Br

InChI

InChI=1S/C15H16BrN3O5S/c1-4-25(21,22)15-17-8-10(16)13(19-15)14(20)18-11-7-9(23-2)5-6-12(11)24-3/h5-8H,4H2,1-3H3,(H,18,20)