3-methoxy-N-[[5-[4-(octylamino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 3-methoxy-N-[[5-[4-(octylamino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 3-methoxy-N-[[5-[[4-(octylamino)-1-piperidyl]sulfonyl]-2-thienyl]methyl]benzamide CAS Name: 3-methoxy-N-[[5-[[4-(octylamino)-1-piperidinyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 3-methoxy-N-[[5-[4-(octylamino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 3-methoxy-N-[[5-[4-(octylamino)piperidino]sulfonyl-2-thienyl]methyl]benzamide Formula: C26H39N3O4S2 MolecularWeight: 521.73556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCCCNC1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C26H39N3O4S2/c1-3-4-5-6-7-8-16-27-22-14-17-29(18-15-22)35(31,32)25-13-12-24(34-25)20-28-26(30)21-10-9-11-23(19-21)33-2/h9-13,19,22,27H,3-8,14-18,20H2,1-2H3,(H,28,30)