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

Systemtic Name: (2-oxidanylideneazepan-3-yl) 3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (2-oxoazepan-3-yl) 3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid (2-ketoazepan-3-yl) ester Formula: C15H17N3O4S MolecularWeight: 335.37818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)OC3CCCCNC3=O

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)OC3CCCCNC3=O

InChI

InChI=1S/C15H17N3O4S/c1-8-10-13(17-7-18(2)14(10)20)23-11(8)15(21)22-9-5-3-4-6-16-12(9)19/h7,9H,3-6H2,1-2H3,(H,16,19)