1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxidanyl-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxidanyl-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-hydroxy-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-pentoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-hydroxy-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(3-amoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C33H32N2O5S MolecularWeight: 568.68258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)OCC)O)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)OCC)O)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C33H32N2O5S/c1-3-5-9-19-40-24-14-10-13-23(20-24)30-29(27(36)18-15-22-11-7-6-8-12-22)31(37)32(38)35(30)33-34-26-17-16-25(39-4-2)21-28(26)41-33/h6-8,10-18,20-21,30,37H,3-5,9,19H2,1-2H3/b18-15+