(3E)-6-chloranyl-3-[5-(3,4-dimethoxyphenyl)-1-methylsulfonyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one

Systemtic Name: (3E)-6-chloranyl-3-[5-(3,4-dimethoxyphenyl)-1-methylsulfonyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one Openeye Name: (3E)-6-chloro-3-[5-(3,4-dimethoxyphenyl)-1-methylsulfonyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one CAS Name: (3E)-6-chloro-3-[5-(3,4-dimethoxyphenyl)-1-methylsulfonyl-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: (3E)-6-chloro-3-[5-(3,4-dimethoxyphenyl)-1-methylsulfonylpyrazolidin-3-ylidene]-4-phenylquinolin-2-one Traditional Name: (3E)-6-chloro-3-[5-(3,4-dimethoxyphenyl)-1-mesyl-pyrazolidin-3-ylidene]-4-phenyl-carbostyril Formula: C27H24ClN3O5S MolecularWeight: 538.01456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)NN2S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C/C(=C\3/C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)/NN2S(=O)(=O)C)OC

InChI

InChI=1S/C27H24ClN3O5S/c1-35-23-12-9-17(13-24(23)36-2)22-15-21(30-31(22)37(3,33)34)26-25(16-7-5-4-6-8-16)19-14-18(28)10-11-20(19)29-27(26)32/h4-14,22,30H,15H2,1-3H3/b26-21+