5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-7-oxidanylidene-1-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidine-3-carboxamide

Systemtic Name: 5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-7-oxidanylidene-1-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidine-3-carboxamide Openeye Name: 5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-7-oxo-1-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidine-3-carboxamide CAS Name: 5-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]-7-oxo-1-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidine-3-carboxamide IUPAC Name: 5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxyphenyl]-7-oxo-1-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidine-3-carboxamide Traditional Name: 7-keto-5-[5-(4-methylpiperazino)sulfonyl-2-propoxy-phenyl]-1-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidine-3-carboxamide Formula: C26H30N8O5S MolecularWeight: 566.632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C3=NC(=O)C4=C(N3)C(=NN4CC5=CC=CC=N5)C(=O)N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)C3=NC(=O)C4=C(N3)C(=NN4CC5=CC=CC=N5)C(=O)N

InChI

InChI=1S/C26H30N8O5S/c1-3-14-39-20-8-7-18(40(37,38)33-12-10-32(2)11-13-33)15-19(20)25-29-21-22(24(27)35)31-34(23(21)26(36)30-25)16-17-6-4-5-9-28-17/h4-9,15H,3,10-14,16H2,1-2H3,(H2,27,35)(H,29,30,36)