4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[3-(1-methylpyrrolidin-2-yl)pyridin-2-yl]benzenesulfonamide

Systemtic Name: 4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[3-(1-methylpyrrolidin-2-yl)pyridin-2-yl]benzenesulfonamide Openeye Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridyl]benzenesulfonamide CAS Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[3-(1-methyl-2-pyrrolidinyl)-2-pyridinyl]benzenesulfonamide IUPAC Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[3-(1-methylpyrrolidin-2-yl)pyridin-2-yl]benzenesulfonamide Traditional Name: 4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[3-(1-methylpyrrolidin-2-yl)-2-pyridyl]benzenesulfonamide Formula: C27H33N7O4S MolecularWeight: 551.66042

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=C(C=CC=N4)C5CCCN5C)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=C(C=CC=N4)C5CCCN5C)OCC)C

InChI

InChI=1S/C27H33N7O4S/c1-5-9-20-23-24(34(4)31-20)27(35)30-26(29-23)19-16-17(12-13-22(19)38-6-2)39(36,37)32-25-18(10-7-14-28-25)21-11-8-15-33(21)3/h7,10,12-14,16,21H,5-6,8-9,11,15H2,1-4H3,(H,28,32)(H,29,30,35)