2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[2-(4-mesylpiperazino)phenyl]acetamide Formula: C19H25N5O3S2 MolecularWeight: 435.5635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC=C2N3CCN(CC3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC=C2N3CCN(CC3)S(=O)(=O)C)C

InChI

InChI=1S/C19H25N5O3S2/c1-14-12-15(2)21-19(20-14)28-13-18(25)22-16-6-4-5-7-17(16)23-8-10-24(11-9-23)29(3,26)27/h4-7,12H,8-11,13H2,1-3H3,(H,22,25)