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

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-oxidanyl-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-phenoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-(3-phenoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-(3-phenoxyphenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C34H26N2O4S MolecularWeight: 558.64624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C=CC4=CC=CC=C4)C5=CC(=CC=C5)OC6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)/C=C/C4=CC=CC=C4)C5=CC(=CC=C5)OC6=CC=CC=C6)C

InChI

InChI=1S/C34H26N2O4S/c1-21-18-22(2)30-28(19-21)41-34(35-30)36-31(24-12-9-15-26(20-24)40-25-13-7-4-8-14-25)29(32(38)33(36)39)27(37)17-16-23-10-5-3-6-11-23/h3-20,31,38H,1-2H3/b17-16+