2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-[(4-methylphenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-[(4-methylphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(p-tolylmethylene)thiazol-4-one CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-5-[(4-methylphenyl)methylidene]-4-thiazolone IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-[(4-methylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-5-(4-methylbenzylidene)-2-thiazolin-4-one Formula: C17H22N3O2S+ MolecularWeight: 332.44048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CC[NH+](CC3)CCO

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CC[NH+](CC3)CCO

InChI

InChI=1S/C17H21N3O2S/c1-13-2-4-14(5-3-13)12-15-16(22)18-17(23-15)20-8-6-19(7-9-20)10-11-21/h2-5,12,21H,6-11H2,1H3/p+1