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

Systemtic Name: 5-methyl-7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione Openeye Name: 5-methyl-7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-thiazolo[4,5-d]pyrimidine-2-thione CAS Name: 5-methyl-7-(4-methyl-1-piperazin-4-iumyl)-3-phenyl-2-thiazolo[4,5-d]pyrimidinethione IUPAC Name: 5-methyl-7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione Traditional Name: 5-methyl-7-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-thiazolo[4,5-d]pyrimidine-2-thione Formula: C17H20N5S2+ MolecularWeight: 358.5042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CC[NH+](CC3)C)SC(=S)N2C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CC[NH+](CC3)C)SC(=S)N2C4=CC=CC=C4

InChI

InChI=1S/C17H19N5S2/c1-12-18-15(21-10-8-20(2)9-11-21)14-16(19-12)22(17(23)24-14)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3/p+1