5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-3-ethyl-2-(phenylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-3-ethyl-2-(phenylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 2-benzyl-5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridyl]-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinyl]-3-ethyl-2-(phenylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 2-benzyl-5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridin-3-yl]-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 2-benzyl-5-[2-ethoxy-5-(4-ethylpiperazino)sulfonyl-3-pyridyl]-3-ethyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C27H33N7O4S MolecularWeight: 551.66042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NN1CC3=CC=CC=C3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)N5CCN(CC5)CC

Isomeric SMILES

CCC1=C2C(=NN1CC3=CC=CC=C3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)N5CCN(CC5)CC

InChI

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