2-methyl-4-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-methyl-4-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Openeye Name: 2-methyl-4-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]thiazole CAS Name: 2-methyl-4-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazin-1-iumyl]methyl]thiazole IUPAC Name: 2-methyl-4-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Traditional Name: 2-methyl-4-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]thiazole Formula: C15H20N7S+ MolecularWeight: 330.4312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH+]2CCN(CC2)C3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=NC(=CS1)C[NH+]2CCN(CC2)C3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C15H19N7S/c1-11-19-12(9-23-11)8-21-3-5-22(6-4-21)15-13-7-18-20(2)14(13)16-10-17-15/h7,9-10H,3-6,8H2,1-2H3/p+1