2-methylpropyl N'-(2-pyrrolidin-1-ium-1-ylethyl)-N-thiophen-2-ylcarbonyl-carbamimidate

Systemtic Name: 2-methylpropyl N'-(2-pyrrolidin-1-ium-1-ylethyl)-N-thiophen-2-ylcarbonyl-carbamimidate Openeye Name: N-[C-isobutoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]thiophene-2-carboxamide CAS Name: N-[oxo(thiophen-2-yl)methyl]-N'-[2-(1-pyrrolidin-1-iumyl)ethyl]carbamimidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N'-(2-pyrrolidin-1-ium-1-ylethyl)-N-(thiophene-2-carbonyl)carbamimidate Traditional Name: N-[C-isobutoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]thiophene-2-carboxamide Formula: C16H26N3O2S+ MolecularWeight: 324.46154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=NCC[NH+]1CCCC1)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)COC(=NCC[NH+]1CCCC1)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H25N3O2S/c1-13(2)12-21-16(17-7-10-19-8-3-4-9-19)18-15(20)14-6-5-11-22-14/h5-6,11,13H,3-4,7-10,12H2,1-2H3,(H,17,18,20)/p+1