N-[(4-methylsulfonylphenyl)methyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[(4-methylsulfonylphenyl)methyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[(4-methylsulfonylphenyl)methyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[(4-methylsulfonylphenyl)methyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[(4-methylsulfonylphenyl)methyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-(4-mesylbenzyl)-3-(2-pyrimidylamino)benzamide Formula: C19H18N4O3S MolecularWeight: 382.43622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3

InChI

InChI=1S/C19H18N4O3S/c1-27(25,26)17-8-6-14(7-9-17)13-22-18(24)15-4-2-5-16(12-15)23-19-20-10-3-11-21-19/h2-12H,13H2,1H3,(H,22,24)(H,20,21,23)