3-[[6-(2-methoxyethoxycarbonyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-4-methyl-benzoic acid

Systemtic Name: 3-[[6-(2-methoxyethoxycarbonyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-4-methyl-benzoic acid Openeye Name: 3-[[6-(2-methoxyethoxycarbonyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-4-methyl-benzoic acid CAS Name: 3-[[6-[2-methoxyethoxy(oxo)methyl]-5-methyl-4-thieno[2,3-d]pyrimidinyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[[6-(2-methoxyethoxycarbonyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]amino]-4-methylbenzoic acid Traditional Name: 3-[[6-(2-methoxyethoxycarbonyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-4-methyl-benzoic acid Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=C3C(=C(SC3=NC=N2)C(=O)OCCOC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=C3C(=C(SC3=NC=N2)C(=O)OCCOC)C

InChI

InChI=1S/C19H19N3O5S/c1-10-4-5-12(18(23)24)8-13(10)22-16-14-11(2)15(19(25)27-7-6-26-3)28-17(14)21-9-20-16/h4-5,8-9H,6-7H2,1-3H3,(H,23,24)(H,20,21,22)