2-(2-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]ethanamide

Systemtic Name: 2-(2-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]ethanamide Openeye Name: 2-(2-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2-methylphenoxy)-N-[2-(4-methyl-1-piperazinyl)-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)-5-piperidin-1-ylsulfonylphenyl]acetamide Traditional Name: 2-(2-methylphenoxy)-N-[2-(4-methylpiperazino)-5-piperidinosulfonyl-phenyl]acetamide Formula: C25H34N4O4S MolecularWeight: 486.62686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCN(CC4)C

InChI

InChI=1S/C25H34N4O4S/c1-20-8-4-5-9-24(20)33-19-25(30)26-22-18-21(34(31,32)29-12-6-3-7-13-29)10-11-23(22)28-16-14-27(2)15-17-28/h4-5,8-11,18H,3,6-7,12-17,19H2,1-2H3,(H,26,30)