4-[4-ethoxy-3-(4-oxidanylidene-8-propyl-1H-pyrido[3,2-d]pyrimidin-2-yl)phenyl]sulfonylpiperazine-1-carboxylic acid

Systemtic Name: 4-[4-ethoxy-3-(4-oxidanylidene-8-propyl-1H-pyrido[3,2-d]pyrimidin-2-yl)phenyl]sulfonylpiperazine-1-carboxylic acid Openeye Name: 4-[4-ethoxy-3-(4-oxo-8-propyl-1H-pyrido[3,2-d]pyrimidin-2-yl)phenyl]sulfonylpiperazine-1-carboxylic acid CAS Name: 4-[4-ethoxy-3-(4-oxo-8-propyl-1H-pyrido[3,2-d]pyrimidin-2-yl)phenyl]sulfonyl-1-piperazinecarboxylic acid IUPAC Name: 4-[4-ethoxy-3-(4-oxo-8-propyl-1H-pyrido[3,2-d]pyrimidin-2-yl)phenyl]sulfonylpiperazine-1-carboxylic acid Traditional Name: 4-[4-ethoxy-3-(4-keto-8-propyl-1H-pyrido[3,2-d]pyrimidin-2-yl)phenyl]sulfonylpiperazine-1-carboxylic acid Formula: C23H27N5O6S MolecularWeight: 501.55538

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NC=C1)C(=O)N=C(N2)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C(=O)O)OCC

Isomeric SMILES

CCCC1=C2C(=NC=C1)C(=O)N=C(N2)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C(=O)O)OCC

InChI

InChI=1S/C23H27N5O6S/c1-3-5-15-8-9-24-20-19(15)25-21(26-22(20)29)17-14-16(6-7-18(17)34-4-2)35(32,33)28-12-10-27(11-13-28)23(30)31/h6-9,14H,3-5,10-13H2,1-2H3,(H,30,31)(H,25,26,29)