N-(2,5-dimethoxyphenyl)-2-[(2-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[(2-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-(o-tolylmethylsulfonyl)pyrimidine-4-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[(2-methylphenyl)methylsulfonyl]-4-pyrimidinecarboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[(2-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-(2-methylbenzyl)sulfonyl-pyrimidine-4-carboxamide Formula: C21H21N3O5S MolecularWeight: 427.47354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)C2=NC=CC(=N2)C(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)C2=NC=CC(=N2)C(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H21N3O5S/c1-14-6-4-5-7-15(14)13-30(26,27)21-22-11-10-17(24-21)20(25)23-18-12-16(28-2)8-9-19(18)29-3/h4-12H,13H2,1-3H3,(H,23,25)