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

Systemtic Name: 1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanyl-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-pentoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-2-(3-pentoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(3-amoxyphenyl)-3-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C32H30N2O4S MolecularWeight: 538.6566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H30N2O4S/c1-3-4-8-18-38-24-13-9-12-23(20-24)29-28(26(35)17-15-22-10-6-5-7-11-22)30(36)31(37)34(29)32-33-25-16-14-21(2)19-27(25)39-32/h5-7,9-17,19-20,29,36H,3-4,8,18H2,1-2H3/b17-15+