N-(4-aminocarbonylphenyl)-5-bromanyl-2-ethylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-5-bromanyl-2-ethylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(4-carbamoylphenyl)-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(4-carbamoylphenyl)-2-ethylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-(4-carbamoylphenyl)-2-ethylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-(4-carbamoylphenyl)-2-esyl-pyrimidine-4-carboxamide Formula: C14H13BrN4O4S MolecularWeight: 413.24642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN4O4S/c1-2-24(22,23)14-17-7-10(15)11(19-14)13(21)18-9-5-3-8(4-6-9)12(16)20/h3-7H,2H2,1H3,(H2,16,20)(H,18,21)