2-(4-ethylpiperazin-4-ium-1-yl)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5-[(4-hydroxyphenyl)methylene]thiazol-4-one CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-5-[(4-hydroxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5-(4-hydroxybenzylidene)-2-thiazolin-4-one Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=O)C(=CC3=CC=C(C=C3)O)S2

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=O)C(=CC3=CC=C(C=C3)O)S2

InChI

InChI=1S/C16H19N3O2S/c1-2-18-7-9-19(10-8-18)16-17-15(21)14(22-16)11-12-3-5-13(20)6-4-12/h3-6,11,20H,2,7-10H2,1H3/p+1