4-[(6-ethoxycarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]benzoate

Systemtic Name: 4-[(6-ethoxycarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]benzoate Openeye Name: 4-[(6-ethoxycarbonyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)methyl]benzoate CAS Name: 4-[(6-ethoxycarbonyl-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]benzoate IUPAC Name: 4-[(6-ethoxycarbonyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]benzoate Traditional Name: 4-[(6-carbethoxy-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)methyl]benzoate Formula: C18H15N2O5S- MolecularWeight: 371.3871

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=C(C=C3)C(=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=C(C=C3)C(=O)[O-])C

InChI

InChI=1S/C18H16N2O5S/c1-3-25-18(24)14-10(2)13-15(26-14)19-9-20(16(13)21)8-11-4-6-12(7-5-11)17(22)23/h4-7,9H,3,8H2,1-2H3,(H,22,23)/p-1