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

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-pentoxy-phenyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-pentoxy-phenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-pentoxyphenyl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-pentoxyphenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(4-amoxy-3-ethoxy-phenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C35H36N2O6S MolecularWeight: 612.73514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H36N2O6S/c1-4-7-11-20-43-28-19-15-24(21-29(28)42-6-3)32-31(27(38)18-14-23-12-9-8-10-13-23)33(39)34(40)37(32)35-36-26-17-16-25(41-5-2)22-30(26)44-35/h8-10,12-19,21-22,32,39H,4-7,11,20H2,1-3H3/b18-14+