7-(3-chlorophenyl)-4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(3-chlorophenyl)-4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(3-chlorophenyl)-4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(3-chlorophenyl)-4-(4-ethyl-1-piperazin-4-iumyl)-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(3-chlorophenyl)-4-(4-ethylpiperazin-4-ium-1-yl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(3-chlorophenyl)-4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C24H25ClN5+ MolecularWeight: 418.9418

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC=NC3=C2C(=CN3C4=CC(=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC=NC3=C2C(=CN3C4=CC(=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C24H24ClN5/c1-2-28-11-13-29(14-12-28)23-22-21(18-7-4-3-5-8-18)16-30(24(22)27-17-26-23)20-10-6-9-19(25)15-20/h3-10,15-17H,2,11-14H2,1H3/p+1