[5-[[N'-(4-methoxyphenyl)carbamimidoyl]sulfanylmethyl]furan-2-yl]methyl-dimethyl-azanium

Systemtic Name: [5-[[N'-(4-methoxyphenyl)carbamimidoyl]sulfanylmethyl]furan-2-yl]methyl-dimethyl-azanium Openeye Name: [5-[[N'-(4-methoxyphenyl)carbamimidoyl]sulfanylmethyl]-2-furyl]methyl-dimethyl-ammonium CAS Name: [5-[[[amino-(4-methoxyphenyl)iminomethyl]thio]methyl]-2-furanyl]methyl-dimethylammonium IUPAC Name: [5-[[N'-(4-methoxyphenyl)carbamimidoyl]sulfanylmethyl]furan-2-yl]methyl-dimethylazanium Traditional Name: [5-[[[N'-(4-methoxyphenyl)amidino]thio]methyl]-2-furyl]methyl-dimethyl-ammonium Formula: C16H22N3O2S+ MolecularWeight: 320.42978

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(O1)CSC(=NC2=CC=C(C=C2)OC)N

Isomeric SMILES

C[NH+](C)CC1=CC=C(O1)CSC(=NC2=CC=C(C=C2)OC)N

InChI

InChI=1S/C16H21N3O2S/c1-19(2)10-14-8-9-15(21-14)11-22-16(17)18-12-4-6-13(20-3)7-5-12/h4-9H,10-11H2,1-3H3,(H2,17,18)/p+1