6-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1H-pyrrolo[3,4-d]pyrimidine-4,5,7-trione

Systemtic Name: 6-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1H-pyrrolo[3,4-d]pyrimidine-4,5,7-trione Openeye Name: 6-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1H-pyrrolo[3,4-d]pyrimidine-4,5,7-trione CAS Name: 6-butyl-2-[2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-1H-pyrrolo[3,4-d]pyrimidine-4,5,7-trione IUPAC Name: 6-butyl-2-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1H-pyrrolo[3,4-d]pyrimidine-4,5,7-trione Traditional Name: 6-butyl-2-[2-ethoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-1H-pyrrolo[3,4-d]pyrimidine-4,5,7-trione Formula: C23H29N5O6S MolecularWeight: 503.57126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC

InChI

InChI=1S/C23H29N5O6S/c1-4-6-9-28-22(30)18-19(23(28)31)24-20(25-21(18)29)16-14-15(7-8-17(16)34-5-2)35(32,33)27-12-10-26(3)11-13-27/h7-8,14H,4-6,9-13H2,1-3H3,(H,24,25,29)