diethyl-[[4-[[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[4-[[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[4-[[(2-methoxy-4-methylsulfanyl-benzoyl)amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[4-[[[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[4-[[(2-methoxy-4-methylsulfanylbenzoyl)amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[4-[[[2-methoxy-4-(methylthio)benzoyl]amino]methyl]benzyl]ammonium Formula: C21H29N2O2S+ MolecularWeight: 373.53216

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=C(C=C(C=C2)SC)OC

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=C(C=C(C=C2)SC)OC

InChI

InChI=1S/C21H28N2O2S/c1-5-23(6-2)15-17-9-7-16(8-10-17)14-22-21(24)19-12-11-18(26-4)13-20(19)25-3/h7-13H,5-6,14-15H2,1-4H3,(H,22,24)/p+1