5-ethyl-4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: 5-ethyl-4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]thiophene-2-carboxamide Openeye Name: 5-ethyl-4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(1-piperidylsulfonyl)phenyl]thiophene-2-carboxamide CAS Name: 5-ethyl-4-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-5-(1-piperidinylsulfonyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 5-ethyl-4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonylphenyl]thiophene-2-carboxamide Traditional Name: 5-ethyl-4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidinosulfonyl-phenyl]thiophene-2-carboxamide Formula: C24H35N4O3S2+ MolecularWeight: 491.6897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CC[NH+](CC4)C)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C24H34N4O3S2/c1-4-22-18(2)16-23(32-22)24(29)25-20-17-19(33(30,31)28-10-6-5-7-11-28)8-9-21(20)27-14-12-26(3)13-15-27/h8-9,16-17H,4-7,10-15H2,1-3H3,(H,25,29)/p+1