3-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-5-methyl-isoxazole-4-carboxamide CAS Name: 3-ethyl-N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(4-morpholinylsulfonyl)phenyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonylphenyl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-ethyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-5-methyl-isoxazole-4-carboxamide Formula: C23H34N5O5S+ MolecularWeight: 492.61156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CC[NH+](CC4)CC)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CC[NH+](CC4)CC)C

InChI

InChI=1S/C23H33N5O5S/c1-4-19-22(17(3)33-25-19)23(29)24-20-16-18(34(30,31)28-12-14-32-15-13-28)6-7-21(20)27-10-8-26(5-2)9-11-27/h6-7,16H,4-5,8-15H2,1-3H3,(H,24,29)/p+1