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

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-oxidanyl-phenyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxy-phenyl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C28H21ClN2O5S MolecularWeight: 532.99474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)Cl)O)C(=O)C=CC5=CC=CC=C5)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)Cl)O)C(=O)/C=C/C5=CC=CC=C5)O

InChI

InChI=1S/C28H21ClN2O5S/c1-2-36-22-14-17(9-13-20(22)32)25-24(21(33)12-8-16-6-4-3-5-7-16)26(34)27(35)31(25)28-30-19-11-10-18(29)15-23(19)37-28/h3-15,25,32,34H,2H2,1H3/b12-8+