furan-2-ylmethyl-[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[2-[2-(o-tolyl)ethylamino]-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[2-keto-2-[2-(o-tolyl)ethylamino]ethyl]-(2-thenyl)ammonium Formula: C21H25N2O2S+ MolecularWeight: 369.5004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3

InChI

InChI=1S/C21H24N2O2S/c1-17-6-2-3-7-18(17)10-11-22-21(24)16-23(14-19-8-4-12-25-19)15-20-9-5-13-26-20/h2-9,12-13H,10-11,14-16H2,1H3,(H,22,24)/p+1