[6-(2-methoxyethoxycarbonyl)-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [6-(2-methoxyethoxycarbonyl)-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(2-phenoxyethyl)azanium Openeye Name: [6-(2-methoxyethoxycarbonyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(2-phenoxyethyl)ammonium CAS Name: [6-[2-methoxyethoxy(oxo)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [6-(2-methoxyethoxycarbonyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(2-phenoxyethyl)azanium Traditional Name: [4-keto-6-(2-methoxyethoxycarbonyl)-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl]methyl-methyl-(2-phenoxyethyl)ammonium Formula: C21H26N3O5S+ MolecularWeight: 432.51324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C[NH+](C)CCOC3=CC=CC=C3)C(=O)OCCOC

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C[NH+](C)CCOC3=CC=CC=C3)C(=O)OCCOC

InChI

InChI=1S/C21H25N3O5S/c1-14-17-19(25)22-16(13-24(2)9-10-28-15-7-5-4-6-8-15)23-20(17)30-18(14)21(26)29-12-11-27-3/h4-8H,9-13H2,1-3H3,(H,22,23,25)/p+1