2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(1-methyl-5-phenyl-2-imidazolyl)thio]-N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(1-methyl-5-phenylimidazol-2-yl)sulfanyl-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]-N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]acetamide Formula: C24H29N4O2S+ MolecularWeight: 437.57766

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=CN=C1SCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2S/c1-27-22(21-5-3-2-4-6-21)16-26-24(27)31-18-23(29)25-15-19-7-9-20(10-8-19)17-28-11-13-30-14-12-28/h2-10,16H,11-15,17-18H2,1H3,(H,25,29)/p+1