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

Systemtic Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-[(3-phenoxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-[(3-phenoxyphenyl)methylene]thiazol-4-one CAS Name: (5Z)-2-(4-ethyl-1-piperazin-4-iumyl)-5-[(3-phenoxyphenyl)methylidene]-4-thiazolone IUPAC Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-[(3-phenoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-2-(4-ethylpiperazin-4-ium-1-yl)-5-(3-phenoxybenzylidene)-2-thiazolin-4-one Formula: C22H24N3O2S+ MolecularWeight: 394.50986

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=O)C(=CC3=CC(=CC=C3)OC4=CC=CC=C4)S2

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=O)/C(=C/C3=CC(=CC=C3)OC4=CC=CC=C4)/S2

InChI

InChI=1S/C22H23N3O2S/c1-2-24-11-13-25(14-12-24)22-23-21(26)20(28-22)16-17-7-6-10-19(15-17)27-18-8-4-3-5-9-18/h3-10,15-16H,2,11-14H2,1H3/p+1/b20-16-