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

Systemtic Name: 3-methylbutyl 2-(6-aminocarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: isopentyl 2-(6-carbamoyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 2-(6-carbamoyl-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-(6-carbamoyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 2-(6-carbamoyl-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid isoamyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)OCCC(C)C)C(=O)N

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)OCCC(C)C)C(=O)N

InChI

InChI=1S/C16H21N3O4S/c1-8(2)5-6-23-16(22)10(4)19-7-18-14-11(15(19)21)9(3)12(24-14)13(17)20/h7-8,10H,5-6H2,1-4H3,(H2,17,20)