N-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-4-methyl-piperazine-1-sulfonamide

Systemtic Name: N-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-4-methyl-piperazine-1-sulfonamide Openeye Name: N-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-4-methyl-piperazine-1-sulfonamide CAS Name: N-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-4-methyl-1-piperazinesulfonamide IUPAC Name: N-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-4-methylpiperazine-1-sulfonamide Traditional Name: N-[4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-4-methyl-piperazine-1-sulfonamide Formula: C22H31N7O4S MolecularWeight: 489.59104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NS(=O)(=O)N4CCN(CC4)C)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NS(=O)(=O)N4CCN(CC4)C)OCC)C

InChI

InChI=1S/C22H31N7O4S/c1-5-7-17-19-20(28(4)25-17)22(30)24-21(23-19)16-14-15(8-9-18(16)33-6-2)26-34(31,32)29-12-10-27(3)11-13-29/h8-9,14,26H,5-7,10-13H2,1-4H3,(H,23,24,30)