4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,4-diazepan-4-ium-1-carbothioamide

Systemtic Name: 4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,4-diazepan-4-ium-1-carbothioamide Openeye Name: 4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,4-diazepan-4-ium-1-carbothioamide CAS Name: 4-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-1,4-diazepan-4-ium-1-carbothioamide IUPAC Name: 4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,4-diazepan-4-ium-1-carbothioamide Traditional Name: 4-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,4-diazepan-4-ium-1-carbothioamide Formula: C14H30N4OS+2 MolecularWeight: 302.4792

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=S)NCCC[NH+]2CCOCC2

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=S)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C14H28N4OS/c1-16-5-3-7-18(9-8-16)14(20)15-4-2-6-17-10-12-19-13-11-17/h2-13H2,1H3,(H,15,20)/p+2