[2-(4-methylphenyl)-1,3-thiazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(p-tolyl)thiazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [2-(4-methylphenyl)-4-thiazolyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(p-tolyl)thiazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C20H21N4OS+ MolecularWeight: 365.47194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C20H20N4OS/c1-15-5-7-16(8-6-15)19-22-17(14-26-19)20(25)24-12-10-23(11-13-24)18-4-2-3-9-21-18/h2-9,14H,10-13H2,1H3/p+1