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

Systemtic Name: 2-(3-ethoxy-4-propoxy-phenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(3-ethoxy-4-propoxy-phenyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(3-ethoxy-4-propoxyphenyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 2-(3-ethoxy-4-propoxyphenyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(3-ethoxy-4-propoxy-phenyl)-3-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C32H30N2O5S MolecularWeight: 554.656

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)C)O)C(=O)C=CC5=CC=CC=C5)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)C)O)C(=O)/C=C/C5=CC=CC=C5)OCC

InChI

InChI=1S/C32H30N2O5S/c1-4-17-39-25-16-13-22(19-26(25)38-5-2)29-28(24(35)15-12-21-9-7-6-8-10-21)30(36)31(37)34(29)32-33-23-14-11-20(3)18-27(23)40-32/h6-16,18-19,29,36H,4-5,17H2,1-3H3/b15-12+