methyl (2R,4R)-4-oxidanyl-1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4R)-4-oxidanyl-1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4R)-4-hydroxy-1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylate CAS Name: (2R,4R)-4-hydroxy-1-(5-phenyl-4-thieno[2,3-d]pyrimidinyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4R)-4-hydroxy-1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylate Traditional Name: (2R,4R)-4-hydroxy-1-(5-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid methyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)O

Isomeric SMILES

COC(=O)[C@H]1C[C@H](CN1C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)O

InChI

InChI=1S/C18H17N3O3S/c1-24-18(23)14-7-12(22)8-21(14)16-15-13(11-5-3-2-4-6-11)9-25-17(15)20-10-19-16/h2-6,9-10,12,14,22H,7-8H2,1H3/t12-,14-/m1/s1