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

Systemtic Name: 7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-[1,2]thiazolo[4,5-d]pyrimidine Openeye Name: 7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-isothiazolo[4,5-d]pyrimidine CAS Name: 7-(4-methyl-1-piperazin-4-iumyl)-3-phenylisothiazolo[4,5-d]pyrimidine IUPAC Name: 7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-[1,2]thiazolo[4,5-d]pyrimidine Traditional Name: 7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-isothiazolo[4,5-d]pyrimidine Formula: C16H18N5S+ MolecularWeight: 312.41262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5S/c1-20-7-9-21(10-8-20)16-15-14(17-11-18-16)13(19-22-15)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3/p+1