4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazol-5-one Openeye Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-2-[4-(1-piperidylsulfonyl)phenyl]oxazol-5-one CAS Name: 4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylidene]-2-[4-(1-piperidinylsulfonyl)phenyl]-5-oxazolone IUPAC Name: 4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazol-5-one Traditional Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-2-(4-piperidinosulfonylphenyl)-2-oxazolin-5-one Formula: C25H23ClN4O4S MolecularWeight: 510.99252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C2C(=O)OC(=N2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C=C2C(=O)OC(=N2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H23ClN4O4S/c1-17-21(23(26)30(28-17)19-8-4-2-5-9-19)16-22-25(31)34-24(27-22)18-10-12-20(13-11-18)35(32,33)29-14-6-3-7-15-29/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3