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

Systemtic Name: N-phenyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-phenyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]thiazol-2-yl]acetamide CAS Name: N-phenyl-N-[4-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-2-thiazolyl]acetamide IUPAC Name: N-phenyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-phenyl-N-[4-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]acetamide Formula: C20H23N6OS+ MolecularWeight: 395.50122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H22N6OS/c1-16(27)26(18-6-3-2-4-7-18)20-23-17(15-28-20)14-24-10-12-25(13-11-24)19-21-8-5-9-22-19/h2-9,15H,10-14H2,1H3/p+1