N-[4-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[4-[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylphenyl]acetamide CAS Name: N-[4-[[4-[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[4-(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[4-(4-methyl-6-piperidino-pyrimidin-2-yl)piperazino]sulfonylphenyl]acetamide Formula: C22H30N6O3S MolecularWeight: 458.577

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C)N4CCCCC4

InChI

InChI=1S/C22H30N6O3S/c1-17-16-21(26-10-4-3-5-11-26)25-22(23-17)27-12-14-28(15-13-27)32(30,31)20-8-6-19(7-9-20)24-18(2)29/h6-9,16H,3-5,10-15H2,1-2H3,(H,24,29)