dimethyl-[2-[3-(4-methylphenyl)sulfanylpropanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[3-(4-methylphenyl)sulfanylpropanoylamino]ethyl]azanium Openeye Name: dimethyl-[2-[3-(p-tolylsulfanyl)propanoylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[3-[(4-methylphenyl)thio]-1-oxopropyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[3-(4-methylphenyl)sulfanylpropanoylamino]ethyl]azanium Traditional Name: dimethyl-[2-[3-(p-tolylthio)propanoylamino]ethyl]ammonium Formula: C14H23N2OS+ MolecularWeight: 267.41022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NCC[NH+](C)C

InChI

InChI=1S/C14H22N2OS/c1-12-4-6-13(7-5-12)18-11-8-14(17)15-9-10-16(2)3/h4-7H,8-11H2,1-3H3,(H,15,17)/p+1