4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenecarbothioamide

Systemtic Name: 4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenecarbothioamide Openeye Name: 4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenecarbothioamide CAS Name: 4-tert-butyl-N-[3-(4-morpholin-4-iumyl)propyl]benzenecarbothioamide IUPAC Name: 4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenecarbothioamide Traditional Name: 4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)thiobenzamide Formula: C18H29N2OS+ MolecularWeight: 321.50066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=S)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=S)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C18H28N2OS/c1-18(2,3)16-7-5-15(6-8-16)17(22)19-9-4-10-20-11-13-21-14-12-20/h5-8H,4,9-14H2,1-3H3,(H,19,22)/p+1