[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(4-methylanilino)thiazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(4-methylanilino)-4-thiazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[2-(p-toluidino)thiazol-4-yl]methanone Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H20N4OS/c1-12-3-5-13(6-4-12)17-16-18-14(11-22-16)15(21)20-9-7-19(2)8-10-20/h3-6,11H,7-10H2,1-2H3,(H,17,18)/p+1