3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 3-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 3-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 3-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)O)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)O)C)C

InChI

InChI=1S/C17H21N3O4S/c1-9-4-10(2)6-19(5-9)12(21)7-20-8-18-15-13(16(20)22)11(3)14(25-15)17(23)24/h8-10H,4-7H2,1-3H3,(H,23,24)