diethyl-[[2-[[2-(4-methoxyphenyl)sulfanylethanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[2-(4-methoxyphenyl)sulfanylethanoylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[[2-(4-methoxyphenyl)sulfanylacetyl]amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[2-[(4-methoxyphenyl)thio]-1-oxoethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[[2-(4-methoxyphenyl)sulfanylacetyl]amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[[[2-[(4-methoxyphenyl)thio]acetyl]amino]methyl]benzyl]ammonium Formula: C21H29N2O2S+ MolecularWeight: 373.53216

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)CSC2=CC=C(C=C2)OC

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)CSC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H28N2O2S/c1-4-23(5-2)15-18-9-7-6-8-17(18)14-22-21(24)16-26-20-12-10-19(25-3)11-13-20/h6-13H,4-5,14-16H2,1-3H3,(H,22,24)/p+1