2-methylpropyl N'-(3-morpholin-4-ium-4-ylpropyl)-N-thiophen-2-ylcarbonyl-carbamimidate

Systemtic Name: 2-methylpropyl N'-(3-morpholin-4-ium-4-ylpropyl)-N-thiophen-2-ylcarbonyl-carbamimidate Openeye Name: N-[C-isobutoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]thiophene-2-carboxamide CAS Name: N'-[3-(4-morpholin-4-iumyl)propyl]-N-[oxo(thiophen-2-yl)methyl]carbamimidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N'-(3-morpholin-4-ium-4-ylpropyl)-N-(thiophene-2-carbonyl)carbamimidate Traditional Name: N-[C-isobutoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]thiophene-2-carboxamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)COC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC=CS2

InChI

InChI=1S/C17H27N3O3S/c1-14(2)13-23-17(19-16(21)15-5-3-12-24-15)18-6-4-7-20-8-10-22-11-9-20/h3,5,12,14H,4,6-11,13H2,1-2H3,(H,18,19,21)/p+1