2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]-9-methyl-1H-purino[9,8-a]pyridin-4-one

Systemtic Name: 2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]-9-methyl-1H-purino[9,8-a]pyridin-4-one Openeye Name: 2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]-9-methyl-1H-purino[9,8-a]pyridin-4-one CAS Name: 2-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-9-methyl-1H-purino[9,8-a]pyridin-4-one IUPAC Name: 2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-9-methyl-1H-purino[9,8-a]pyridin-4-one Traditional Name: 2-[2-ethoxy-5-(4-ethylpiperazino)sulfonyl-phenyl]-9-methyl-1H-purino[9,8-a]pyridin-4-one Formula: C24H28N6O4S MolecularWeight: 496.58192

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC)C3=NC(=O)C4=C(N3)N5C(=CC=CC5=N4)C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC)C3=NC(=O)C4=C(N3)N5C(=CC=CC5=N4)C

InChI

InChI=1S/C24H28N6O4S/c1-4-28-11-13-29(14-12-28)35(32,33)17-9-10-19(34-5-2)18(15-17)22-26-23-21(24(31)27-22)25-20-8-6-7-16(3)30(20)23/h6-10,15H,4-5,11-14H2,1-3H3,(H,26,27,31)