2-[6-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid

Systemtic Name: 2-[6-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[6-methyl-5-[(4-methyl-1-piperidyl)sulfonyl]-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[6-methyl-5-[(4-methyl-1-piperidinyl)sulfonyl]-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-[6-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-[4-keto-6-methyl-5-(4-methylpiperidino)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]acetic acid Formula: C15H19N3O5S2 MolecularWeight: 385.45846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)O)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)O)C

InChI

InChI=1S/C15H19N3O5S2/c1-9-3-5-18(6-4-9)25(22,23)13-10(2)24-14-12(13)15(21)17(8-16-14)7-11(19)20/h8-9H,3-7H2,1-2H3,(H,19,20)