1,5-dimethyl-2-(4-morpholin-4-ylsulfonylphenyl)-4-propan-2-yl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-2-(4-morpholin-4-ylsulfonylphenyl)-4-propan-2-yl-pyrazol-3-one Openeye Name: 4-isopropyl-1,5-dimethyl-2-(4-morpholinosulfonylphenyl)pyrazol-3-one CAS Name: 1,5-dimethyl-2-[4-(4-morpholinylsulfonyl)phenyl]-4-propan-2-yl-3-pyrazolone IUPAC Name: 1,5-dimethyl-2-(4-morpholin-4-ylsulfonylphenyl)-4-propan-2-ylpyrazol-3-one Traditional Name: 4-isopropyl-1,5-dimethyl-2-(4-morpholinosulfonylphenyl)-3-pyrazolin-3-one Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(C)C

InChI

InChI=1S/C18H25N3O4S/c1-13(2)17-14(3)19(4)21(18(17)22)15-5-7-16(8-6-15)26(23,24)20-9-11-25-12-10-20/h5-8,13H,9-12H2,1-4H3