2-[[5-[[4-tert-butyl-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]furan-2-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-[[4-tert-butyl-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]furan-2-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-[[4-tert-butyl-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]furan-2-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-[[[4-tert-butyl-6-(dimethylamino)-2-pyrimidinyl]thio]methyl]-2-furanyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-[[4-tert-butyl-6-(dimethylamino)pyrimidin-2-yl]sulfanylmethyl]furan-2-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5-[[[4-tert-butyl-6-(dimethylamino)pyrimidin-2-yl]thio]methyl]-2-furoyl]amino]ethyl-dimethyl-ammonium Formula: C20H32N5O2S+ MolecularWeight: 406.56538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC[NH+](C)C)N(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC[NH+](C)C)N(C)C

InChI

InChI=1S/C20H31N5O2S/c1-20(2,3)16-12-17(25(6)7)23-19(22-16)28-13-14-8-9-15(27-14)18(26)21-10-11-24(4)5/h8-9,12H,10-11,13H2,1-7H3,(H,21,26)/p+1