N-(4-methylphenyl)-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine

Systemtic Name: N-(4-methylphenyl)-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine Openeye Name: N-(p-tolyl)-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]thiazol-2-amine CAS Name: N-(4-methylphenyl)-4-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-2-thiazolamine IUPAC Name: N-(4-methylphenyl)-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine Traditional Name: p-tolyl-[4-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]amine Formula: C19H23N6S+ MolecularWeight: 367.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H22N6S/c1-15-3-5-16(6-4-15)22-19-23-17(14-26-19)13-24-9-11-25(12-10-24)18-20-7-2-8-21-18/h2-8,14H,9-13H2,1H3,(H,22,23)/p+1