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

Systemtic Name: 3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-propoxyphenyl)pyridin-3-yl]-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-propoxyphenyl)-3-pyridyl]-2-(2-pyridylmethyl)-3,4-dihydro-1H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-ethyl-5-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-(2-propoxyphenyl)-3-pyridinyl]-2-(2-pyridinylmethyl)-3,4-dihydro-1H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-propoxyphenyl)pyridin-3-yl]-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-ethyl-5-[5-(4-ethylpiperazino)sulfonyl-2-(2-propoxyphenyl)-3-pyridyl]-2-(2-pyridylmethyl)-3,4-dihydro-1H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C33H40N8O4S MolecularWeight: 644.7869

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC=C(C=C2C3=NC(=O)C4=C(N3)C(N(N4)CC5=CC=CC=N5)CC)S(=O)(=O)N6CCN(CC6)CC

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC=C(C=C2C3=NC(=O)C4=C(N3)C(N(N4)CC5=CC=CC=N5)CC)S(=O)(=O)N6CCN(CC6)CC

InChI

InChI=1S/C33H40N8O4S/c1-4-19-45-28-13-8-7-12-25(28)29-26(20-24(21-35-29)46(43,44)40-17-15-39(6-3)16-18-40)32-36-30-27(5-2)41(38-31(30)33(42)37-32)22-23-11-9-10-14-34-23/h7-14,20-21,27,38H,4-6,15-19,22H2,1-3H3,(H,36,37,42)