(phenylmethyl) (2R)-2-(6-aminocarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (phenylmethyl) (2R)-2-(6-aminocarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: benzyl (2R)-2-(6-carbamoyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: (2R)-2-(6-carbamoyl-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-(6-carbamoyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: (2R)-2-(6-carbamoyl-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid benzyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)OCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)[C@H](C)C(=O)OCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C18H17N3O4S/c1-10-13-16(26-14(10)15(19)22)20-9-21(17(13)23)11(2)18(24)25-8-12-6-4-3-5-7-12/h3-7,9,11H,8H2,1-2H3,(H2,19,22)/t11-/m1/s1