N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(thiophen-3-ylmethylsulfanyl)benzamide

Systemtic Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(thiophen-3-ylmethylsulfanyl)benzamide Openeye Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(3-thienylmethylsulfanyl)benzamide CAS Name: N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-(3-thiophenylmethylthio)benzamide IUPAC Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(thiophen-3-ylmethylsulfanyl)benzamide Traditional Name: N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-2-(3-thenylthio)benzamide Formula: C24H27N2O2S2+ MolecularWeight: 439.61338

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C24H26N2O2S2/c27-24(22-7-3-4-8-23(22)30-18-19-9-14-29-17-19)25-15-20-5-1-2-6-21(20)16-26-10-12-28-13-11-26/h1-9,14,17H,10-13,15-16,18H2,(H,25,27)/p+1