tert-butyl 2-[(3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]-3-methyl-butanoate

Systemtic Name: tert-butyl 2-[(3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]-3-methyl-butanoate Openeye Name: tert-butyl 2-[(3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl)amino]-3-methyl-butanoate CAS Name: 2-[[(3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]amino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carbonyl)amino]-3-methylbutanoate Traditional Name: 2-[(4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]-3-methyl-butyric acid tert-butyl ester Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC(C(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC(C(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25N3O4S/c1-9(2)12(17(24)25-18(4,5)6)20-14(22)13-10(3)11-15(26-13)19-8-21(7)16(11)23/h8-9,12H,1-7H3,(H,20,22)