4-[2-chloranyl-4-methylsulfonyl-3-(2-phenylmorpholin-4-yl)phenyl]carbonyl-2-ethyl-1H-pyrazol-3-one

Systemtic Name: 4-[2-chloranyl-4-methylsulfonyl-3-(2-phenylmorpholin-4-yl)phenyl]carbonyl-2-ethyl-1H-pyrazol-3-one Openeye Name: 4-[2-chloro-4-methylsulfonyl-3-(2-phenylmorpholin-4-yl)benzoyl]-2-ethyl-1H-pyrazol-3-one CAS Name: 4-[[2-chloro-4-methylsulfonyl-3-(2-phenyl-4-morpholinyl)phenyl]-oxomethyl]-2-ethyl-1H-pyrazol-3-one IUPAC Name: 4-[2-chloro-4-methylsulfonyl-3-(2-phenylmorpholin-4-yl)benzoyl]-2-ethyl-1H-pyrazol-3-one Traditional Name: 4-[2-chloro-4-mesyl-3-(2-phenylmorpholino)benzoyl]-2-ethyl-3-pyrazolin-3-one Formula: C23H24ClN3O5S MolecularWeight: 489.97176

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)N3CCOC(C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)N3CCOC(C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H24ClN3O5S/c1-3-27-23(29)17(13-25-27)22(28)16-9-10-19(33(2,30)31)21(20(16)24)26-11-12-32-18(14-26)15-7-5-4-6-8-15/h4-10,13,18,25H,3,11-12,14H2,1-2H3