1H-indol-4-ylmethyl-[2-(4-methylphenyl)sulfanylethyl]azanium

Systemtic Name: 1H-indol-4-ylmethyl-[2-(4-methylphenyl)sulfanylethyl]azanium Openeye Name: 1H-indol-4-ylmethyl-[2-(p-tolylsulfanyl)ethyl]ammonium CAS Name: 1H-indol-4-ylmethyl-[2-[(4-methylphenyl)thio]ethyl]ammonium IUPAC Name: 1H-indol-4-ylmethyl-[2-(4-methylphenyl)sulfanylethyl]azanium Traditional Name: 1H-indol-4-ylmethyl-[2-(p-tolylthio)ethyl]ammonium Formula: C18H21N2S+ MolecularWeight: 297.43774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC[NH2+]CC2=C3C=CNC3=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCC[NH2+]CC2=C3C=CNC3=CC=C2

InChI

InChI=1S/C18H20N2S/c1-14-5-7-16(8-6-14)21-12-11-19-13-15-3-2-4-18-17(15)9-10-20-18/h2-10,19-20H,11-13H2,1H3/p+1