[(4S)-5-ethoxycarbonyl-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(4S)-5-ethoxycarbonyl-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(thiophen-2-ylmethyl)azanium Openeye Name: [(4S)-5-ethoxycarbonyl-4-(2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(2-thienylmethyl)ammonium CAS Name: [(4S)-5-ethoxycarbonyl-4-(2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(4S)-5-ethoxycarbonyl-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(thiophen-2-ylmethyl)azanium Traditional Name: [(4S)-5-carbethoxy-4-(2-furyl)-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(2-thenyl)ammonium Formula: C19H24N3O4S+ MolecularWeight: 390.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)CC2=C(C(NC(=O)N2)C3=CC=CO3)C(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC=CS1)CC2=C([C@H](NC(=O)N2)C3=CC=CO3)C(=O)OCC

InChI

InChI=1S/C19H23N3O4S/c1-3-22(11-13-7-6-10-27-13)12-14-16(18(23)25-4-2)17(21-19(24)20-14)15-8-5-9-26-15/h5-10,17H,3-4,11-12H2,1-2H3,(H2,20,21,24)/p+1/t17-/m1/s1