2,5-dimethyl-3-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2,5-dimethyl-3-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 3-[2-(isobutylamino)-2-oxo-ethyl]-2,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-3-[2-(2-methylpropylamino)-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 2,5-dimethyl-3-[2-(2-methylpropylamino)-2-oxoethyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(isobutylamino)-2-keto-ethyl]-4-keto-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C15H18N3O4S- MolecularWeight: 336.38612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)C)CC(=O)NCC(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)C)CC(=O)NCC(C)C)C(=O)[O-]

InChI

InChI=1S/C15H19N3O4S/c1-7(2)5-16-10(19)6-18-9(4)17-13-11(14(18)20)8(3)12(23-13)15(21)22/h7H,5-6H2,1-4H3,(H,16,19)(H,21,22)/p-1