3-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-1,3-thiazol-2-one

Systemtic Name: 3-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-1,3-thiazol-2-one Openeye Name: 3-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-thiazol-2-one CAS Name: 3-[2-[4-(5-chloro-2-methylphenyl)-1-piperazin-1-iumyl]ethyl]-4-methyl-2-thiazolone IUPAC Name: 3-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-1,3-thiazol-2-one Traditional Name: 3-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-4-methyl-4-thiazolin-2-one Formula: C17H23ClN3OS+ MolecularWeight: 352.90202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CCN3C(=CSC3=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CCN3C(=CSC3=O)C

InChI

InChI=1S/C17H22ClN3OS/c1-13-3-4-15(18)11-16(13)20-8-5-19(6-9-20)7-10-21-14(2)12-23-17(21)22/h3-4,11-12H,5-10H2,1-2H3/p+1