4-(2-methylprop-2-enyl)-N-(3-morpholin-4-ium-4-ylpropyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(2-methylprop-2-enyl)-N-(3-morpholin-4-ium-4-ylpropyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-(2-methylallyl)-N-(3-morpholin-4-ium-4-ylpropyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-(2-methylprop-2-enyl)-N-[3-(4-morpholin-4-iumyl)propyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-(2-methylprop-2-enyl)-N-(3-morpholin-4-ium-4-ylpropyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-(2-methylallyl)-N-(3-morpholin-4-ium-4-ylpropyl)piperazin-4-ium-1-carbothioamide Formula: C16H32N4OS+2 MolecularWeight: 328.51648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H30N4OS/c1-15(2)14-19-6-8-20(9-7-19)16(22)17-4-3-5-18-10-12-21-13-11-18/h1,3-14H2,2H3,(H,17,22)/p+2