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

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one Openeye Name: 2-(3-allyloxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one Traditional Name: 5-(3-allyloxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C29H21ClN2O4S MolecularWeight: 529.00604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H21ClN2O4S/c1-2-15-36-21-10-6-9-19(16-21)26-25(23(33)14-11-18-7-4-3-5-8-18)27(34)28(35)32(26)29-31-22-13-12-20(30)17-24(22)37-29/h2-14,16-17,26,34H,1,15H2/b14-11+