(5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]-1,3-thiazol-4-one

Systemtic Name: (5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]-1,3-thiazol-4-one Openeye Name: (5Z)-2-(4-benzylpiperazin-4-ium-1-yl)-5-[(2,4-dimethoxyphenyl)methylene]thiazol-4-one CAS Name: (5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]-4-thiazolone IUPAC Name: (5Z)-2-(4-benzylpiperazin-4-ium-1-yl)-5-[(2,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-2-(4-benzylpiperazin-4-ium-1-yl)-5-(2,4-dimethoxybenzylidene)-2-thiazolin-4-one Formula: C23H26N3O3S+ MolecularWeight: 424.53584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=C2C(=O)N=C(S2)N3CC[NH+](CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C\2/C(=O)N=C(S2)N3CC[NH+](CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C23H25N3O3S/c1-28-19-9-8-18(20(15-19)29-2)14-21-22(27)24-23(30-21)26-12-10-25(11-13-26)16-17-6-4-3-5-7-17/h3-9,14-15H,10-13,16H2,1-2H3/p+1/b21-14-