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

Systemtic Name: (phenylmethyl) 2-(6-aminocarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: benzyl 2-(6-carbamoyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: 2-(6-carbamoyl-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-carbamoyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: 2-(6-carbamoyl-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)butyric acid benzyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)N2C=NC3=C(C2=O)C(=C(S3)C(=O)N)C

Isomeric SMILES

CCC(C(=O)OCC1=CC=CC=C1)N2C=NC3=C(C2=O)C(=C(S3)C(=O)N)C

InChI

InChI=1S/C19H19N3O4S/c1-3-13(19(25)26-9-12-7-5-4-6-8-12)22-10-21-17-14(18(22)24)11(2)15(27-17)16(20)23/h4-8,10,13H,3,9H2,1-2H3,(H2,20,23)