N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[4-(p-tolyl)thiazol-2-yl]acetamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[4-(p-tolyl)thiazol-2-yl]acetamide Formula: C24H31N6OS+ MolecularWeight: 451.60754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C[NH+]3CCN(CC3)C4=NC(=NC(=C4)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C[NH+]3CCN(CC3)C4=NC(=NC(=C4)C)C(C)C

InChI

InChI=1S/C24H30N6OS/c1-16(2)23-25-18(4)13-21(27-23)30-11-9-29(10-12-30)14-22(31)28-24-26-20(15-32-24)19-7-5-17(3)6-8-19/h5-8,13,15-16H,9-12,14H2,1-4H3,(H,26,28,31)/p+1