2-(4-tert-butylphenyl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]acetamide Formula: C24H33N2O2S+ MolecularWeight: 413.59602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C24H32N2O2S/c1-24(2,3)21-8-10-22(11-9-21)29-18-23(27)25-16-19-4-6-20(7-5-19)17-26-12-14-28-15-13-26/h4-11H,12-18H2,1-3H3,(H,25,27)/p+1