3,4,5-triethoxy-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide CAS Name: 3,4,5-triethoxy-N-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[2-[4-(2-pyrimidyl)piperazino]sulfonylethyl]benzamide Formula: C23H33N5O6S MolecularWeight: 507.60302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C23H33N5O6S/c1-4-32-19-16-18(17-20(33-5-2)21(19)34-6-3)22(29)24-10-15-35(30,31)28-13-11-27(12-14-28)23-25-8-7-9-26-23/h7-9,16-17H,4-6,10-15H2,1-3H3,(H,24,29)