5-bromanyl-N-(2,4-dimethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-N-(2,4-dimethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(2,4-dimethylphenyl)-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-bromo-N-(2,4-dimethylphenyl)-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-N-(2,4-dimethylphenyl)-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-bromo-N-(2,4-dimethylphenyl)-2-mesyl-pyrimidine-4-carboxamide Formula: C14H14BrN3O3S MolecularWeight: 384.24826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NC(=NC=C2Br)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NC(=NC=C2Br)S(=O)(=O)C)C

InChI

InChI=1S/C14H14BrN3O3S/c1-8-4-5-11(9(2)6-8)17-13(19)12-10(15)7-16-14(18-12)22(3,20)21/h4-7H,1-3H3,(H,17,19)