4-morpholin-4-ylsulfonyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]benzamide

Systemtic Name: 4-morpholin-4-ylsulfonyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]benzamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-4-morpholinosulfonyl-benzamide CAS Name: 4-(4-morpholinylsulfonyl)-N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]benzamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-4-morpholinosulfonyl-benzamide Formula: C29H36N4O4S2 MolecularWeight: 568.75054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC(C(C1=CC=CS1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C29H36N4O4S2/c1-23(30-29(34)25-9-11-26(12-10-25)39(35,36)33-17-19-37-20-18-33)28(27-8-5-21-38-27)32-15-13-31(14-16-32)22-24-6-3-2-4-7-24/h2-12,21,23,28H,13-20,22H2,1H3,(H,30,34)