6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-7-iodanyl-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-7-iodanyl-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione Openeye Name: 6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione CAS Name: 6-[2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione IUPAC Name: 6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione Traditional Name: 6-[2-ethoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-quinone Formula: C23H30IN5O5S MolecularWeight: 615.48427

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C)NC(=C2I)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C)NC(=C2I)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC

InChI

InChI=1S/C23H30IN5O5S/c1-5-9-29-21-18(24)19(25-20(21)22(30)27(4)23(29)31)16-14-15(7-8-17(16)34-6-2)35(32,33)28-12-10-26(3)11-13-28/h7-8,14,25H,5-6,9-13H2,1-4H3