4-methyl-3-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3-thiazol-2-one

Systemtic Name: 4-methyl-3-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3-thiazol-2-one Openeye Name: 4-methyl-3-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]thiazol-2-one CAS Name: 4-methyl-3-[2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethyl]-2-thiazolone IUPAC Name: 4-methyl-3-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3-thiazol-2-one Traditional Name: 4-methyl-3-[2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]ethyl]-4-thiazolin-2-one Formula: C14H20N5OS+ MolecularWeight: 306.4065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CC[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=CSC(=O)N1CC[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C14H19N5OS/c1-12-11-21-14(20)19(12)10-7-17-5-8-18(9-6-17)13-15-3-2-4-16-13/h2-4,11H,5-10H2,1H3/p+1