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

Systemtic Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-[(3-methylphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-(m-tolylmethylene)thiazol-4-one CAS Name: (5Z)-2-(4-ethyl-1-piperazin-4-iumyl)-5-[(3-methylphenyl)methylidene]-4-thiazolone IUPAC Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-[(3-methylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-(3-methylbenzylidene)-2-thiazolin-4-one Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3OS/c1-3-19-7-9-20(10-8-19)17-18-16(21)15(22-17)12-14-6-4-5-13(2)11-14/h4-6,11-12H,3,7-10H2,1-2H3/p+1/b15-12-