methyl 4-[(2-thieno[2,3-d]pyrimidin-4-yloxyethanoylamino)methyl]benzoate

Systemtic Name: methyl 4-[(2-thieno[2,3-d]pyrimidin-4-yloxyethanoylamino)methyl]benzoate Openeye Name: methyl 4-[[(2-thieno[2,3-d]pyrimidin-4-yloxyacetyl)amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-(4-thieno[2,3-d]pyrimidinyloxy)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-thieno[2,3-d]pyrimidin-4-yloxyacetyl)amino]methyl]benzoate Traditional Name: 4-[[(2-thieno[2,3-d]pyrimidin-4-yloxyacetyl)amino]methyl]benzoic acid methyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)COC2=C3C=CSC3=NC=N2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)COC2=C3C=CSC3=NC=N2

InChI

InChI=1S/C17H15N3O4S/c1-23-17(22)12-4-2-11(3-5-12)8-18-14(21)9-24-15-13-6-7-25-16(13)20-10-19-15/h2-7,10H,8-9H2,1H3,(H,18,21)