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

Systemtic Name: 3-ethyl-7-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione Openeye Name: 3-ethyl-7-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-thiazolo[4,5-d]pyrimidine-2-thione CAS Name: 3-ethyl-7-(4-methyl-1-piperazin-4-iumyl)-5-phenyl-2-thiazolo[4,5-d]pyrimidinethione IUPAC Name: 3-ethyl-7-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione Traditional Name: 3-ethyl-7-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-thiazolo[4,5-d]pyrimidine-2-thione Formula: C18H22N5S2+ MolecularWeight: 372.53078

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)C3=CC=CC=C3)N4CC[NH+](CC4)C)SC1=S

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)C3=CC=CC=C3)N4CC[NH+](CC4)C)SC1=S

InChI

InChI=1S/C18H21N5S2/c1-3-23-17-14(25-18(23)24)16(22-11-9-21(2)10-12-22)19-15(20-17)13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3/p+1