4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidine Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidine CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-5-phenyl-2-(3-pyridinyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidine Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidine Formula: C23H24N5S+ MolecularWeight: 402.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C3C(=CSC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C3C(=CSC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H23N5S/c1-2-27-11-13-28(14-12-27)22-20-19(17-7-4-3-5-8-17)16-29-23(20)26-21(25-22)18-9-6-10-24-15-18/h3-10,15-16H,2,11-14H2,1H3/p+1