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

Systemtic Name: 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-4-oxo-3-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-4-oxo-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-keto-3-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=CC=CC=N4)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=CC=CC=N4)C(=O)O

InChI

InChI=1S/C19H19N5O4S/c1-12-15-17(29-16(12)19(27)28)21-11-24(18(15)26)10-14(25)23-8-6-22(7-9-23)13-4-2-3-5-20-13/h2-5,11H,6-10H2,1H3,(H,27,28)