N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-5-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-5-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-5-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholin-4-iumyl)propyl]-5-isoxazolecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-5-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-5-carboxamide Formula: C20H25N4O4S+ MolecularWeight: 417.5019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCC[NH+]3CCOCC3)C(=O)C4=CC=NO4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCC[NH+]3CCOCC3)C(=O)C4=CC=NO4

InChI

InChI=1S/C20H24N4O4S/c1-2-27-15-4-5-16-18(14-15)29-20(22-16)24(19(25)17-6-7-21-28-17)9-3-8-23-10-12-26-13-11-23/h4-7,14H,2-3,8-13H2,1H3/p+1