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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-5-carboxamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-5-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-[3-(4-morpholin-4-iumyl)propyl]-5-isoxazolecarboxamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-5-carboxamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-5-carboxamide Formula: C18H20ClN4O3S+ MolecularWeight: 407.8944

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN(C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC=NO4

Isomeric SMILES

C1COCC[NH+]1CCCN(C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC=NO4

InChI

InChI=1S/C18H19ClN4O3S/c19-13-3-1-4-15-16(13)21-18(27-15)23(17(24)14-5-6-20-26-14)8-2-7-22-9-11-25-12-10-22/h1,3-6H,2,7-12H2/p+1