6-[2-ethoxy-5-(4-prop-2-enylpiperazin-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-prop-2-enylpiperazin-1-yl)sulfonyl-phenyl]-7-iodanyl-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione Openeye Name: 6-[5-(4-allylpiperazin-1-yl)sulfonyl-2-ethoxy-phenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione CAS Name: 6-[2-ethoxy-5-[(4-prop-2-enyl-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-prop-2-enylpiperazin-1-yl)sulfonylphenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione Traditional Name: 6-[5-(4-allylpiperazino)sulfonyl-2-ethoxy-phenyl]-7-iodo-3-methyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-quinone Formula: C25H32IN5O5S MolecularWeight: 641.52155

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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)CC=C)OCC

Isomeric SMILES

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

InChI

InChI=1S/C25H32IN5O5S/c1-5-10-29-12-14-30(15-13-29)37(34,35)17-8-9-19(36-7-3)18(16-17)21-20(26)23-22(27-21)24(32)28(4)25(33)31(23)11-6-2/h5,8-9,16,27H,1,6-7,10-15H2,2-4H3