(5E)-5-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4-one Openeye Name: (5E)-5-[(4-benzyloxy-3-ethoxy-phenyl)methylene]-2-(4-phenylpiperazin-1-yl)thiazol-4-one CAS Name: (5E)-5-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-(4-phenyl-1-piperazinyl)-4-thiazolone IUPAC Name: (5E)-5-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4-one Traditional Name: (5E)-5-(4-benzoxy-3-ethoxy-benzylidene)-2-(4-phenylpiperazino)-2-thiazolin-4-one Formula: C29H29N3O3S MolecularWeight: 499.62386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H29N3O3S/c1-2-34-26-19-23(13-14-25(26)35-21-22-9-5-3-6-10-22)20-27-28(33)30-29(36-27)32-17-15-31(16-18-32)24-11-7-4-8-12-24/h3-14,19-20H,2,15-18,21H2,1H3/b27-20+