2-[[3-[(4-methylsulfonylpiperazin-1-yl)methyl]phenyl]carbonylamino]-N-propyl-benzamide

Systemtic Name: 2-[[3-[(4-methylsulfonylpiperazin-1-yl)methyl]phenyl]carbonylamino]-N-propyl-benzamide Openeye Name: 2-[[3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzoyl]amino]-N-propyl-benzamide CAS Name: 2-[[[3-[(4-methylsulfonyl-1-piperazinyl)methyl]phenyl]-oxomethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzoyl]amino]-N-propylbenzamide Traditional Name: 2-[[3-[(4-mesylpiperazino)methyl]benzoyl]amino]-N-propyl-benzamide Formula: C23H30N4O4S MolecularWeight: 458.5737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C23H30N4O4S/c1-3-11-24-23(29)20-9-4-5-10-21(20)25-22(28)19-8-6-7-18(16-19)17-26-12-14-27(15-13-26)32(2,30)31/h4-10,16H,3,11-15,17H2,1-2H3,(H,24,29)(H,25,28)