methyl 4-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)oxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]amino]benzoate Traditional Name: 4-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetyl]amino]benzoic acid methyl ester Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O4S/c1-28-22(27)15-7-9-16(10-8-15)25-18(26)11-29-20-19-17(14-5-3-2-4-6-14)12-30-21(19)24-13-23-20/h2-10,12-13H,11H2,1H3,(H,25,26)