N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide

Systemtic Name: N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide Openeye Name: N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide CAS Name: N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-N-[3-(4-morpholin-4-iumyl)propyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide Traditional Name: N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide Formula: C18H25N4O4S+ MolecularWeight: 393.4805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(CCC[NH+]2CCOCC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(CCC[NH+]2CCOCC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H24N4O4S/c1-14-12-16(20-26-14)19-17(23)13-22(18(24)15-4-2-11-27-15)6-3-5-21-7-9-25-10-8-21/h2,4,11-12H,3,5-10,13H2,1H3,(H,19,20,23)/p+1