[2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxo-ethyl]-(2-furylmethyl)-(2-thienylmethyl)ammonium CAS Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl]-(2-furanylmethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl]-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: [2-[[4-(dimethylamino)benzyl]amino]-2-keto-ethyl]-(2-furfuryl)-(2-thenyl)ammonium Formula: C21H26N3O2S+ MolecularWeight: 384.51504

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3

InChI

InChI=1S/C21H25N3O2S/c1-23(2)18-9-7-17(8-10-18)13-22-21(25)16-24(14-19-5-3-11-26-19)15-20-6-4-12-27-20/h3-12H,13-16H2,1-2H3,(H,22,25)/p+1