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

Systemtic Name: 7-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-[1,2]thiazolo[4,5-d]pyrimidine Openeye Name: 7-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-isothiazolo[4,5-d]pyrimidine CAS Name: 7-(4-ethyl-1-piperazin-4-iumyl)-3-phenylisothiazolo[4,5-d]pyrimidine IUPAC Name: 7-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-[1,2]thiazolo[4,5-d]pyrimidine Traditional Name: 7-(4-ethylpiperazin-4-ium-1-yl)-3-phenyl-isothiazolo[4,5-d]pyrimidine Formula: C17H20N5S+ MolecularWeight: 326.4392

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC=NC3=C2SN=C3C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC=NC3=C2SN=C3C4=CC=CC=C4

InChI

InChI=1S/C17H19N5S/c1-2-21-8-10-22(11-9-21)17-16-15(18-12-19-17)14(20-23-16)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3/p+1