methyl 3-methyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)pentanoate

Systemtic Name: methyl 3-methyl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)pentanoate Openeye Name: methyl 3-methyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]pentanoate CAS Name: 3-methyl-2-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]pentanoate Traditional Name: 3-methyl-2-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]valeric acid methyl ester Formula: C15H19N3O3S2 MolecularWeight: 353.45966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC=NC2=C1C=CS2

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC=NC2=C1C=CS2

InChI

InChI=1S/C15H19N3O3S2/c1-4-9(2)12(15(20)21-3)18-11(19)7-23-14-10-5-6-22-13(10)16-8-17-14/h5-6,8-9,12H,4,7H2,1-3H3,(H,18,19)