2-(4-bromophenyl)sulfanylethyl-[2-[(2-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(4-bromophenyl)sulfanylethyl-[2-[(2-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(4-bromophenyl)sulfanylethyl-[2-[(2-methoxyphenyl)methylamino]-2-oxo-ethyl]ammonium CAS Name: 2-[(4-bromophenyl)thio]ethyl-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]ammonium IUPAC Name: 2-(4-bromophenyl)sulfanylethyl-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]azanium Traditional Name: 2-[(4-bromophenyl)thio]ethyl-[2-keto-2-(o-anisylamino)ethyl]ammonium Formula: C18H22BrN2O2S+ MolecularWeight: 410.34848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C[NH2+]CCSC2=CC=C(C=C2)Br

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C[NH2+]CCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H21BrN2O2S/c1-23-17-5-3-2-4-14(17)12-21-18(22)13-20-10-11-24-16-8-6-15(19)7-9-16/h2-9,20H,10-13H2,1H3,(H,21,22)/p+1