tert-butyl 5-azanyl-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: tert-butyl 5-azanyl-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: tert-butyl 5-amino-2-(2-tert-butoxy-2-oxo-ethyl)sulfanyl-4-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]thio]-4-(methylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-amino-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfanyl-4-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-2-[(2-tert-butoxy-2-keto-ethyl)thio]-4-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid tert-butyl ester Formula: C18H25N3O4S3 MolecularWeight: 443.6038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC2=C(C(=C(S2)C(=O)OC(C)(C)C)N)C(=N1)SC

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC2=C(C(=C(S2)C(=O)OC(C)(C)C)N)C(=N1)SC

InChI

InChI=1S/C18H25N3O4S3/c1-17(2,3)24-9(22)8-27-16-20-13(26-7)10-11(19)12(28-14(10)21-16)15(23)25-18(4,5)6/h8,19H2,1-7H3