5-methyl-4-(4-morpholin-4-ylsulfonylphenyl)carbonyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-methyl-4-(4-morpholin-4-ylsulfonylphenyl)carbonyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-methyl-4-(4-morpholinosulfonylbenzoyl)-2-phenyl-1H-pyrazol-3-one CAS Name: 5-methyl-4-[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-methyl-4-(4-morpholin-4-ylsulfonylbenzoyl)-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-methyl-4-(4-morpholinosulfonylbenzoyl)-2-phenyl-3-pyrazolin-3-one Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21N3O5S/c1-15-19(21(26)24(22-15)17-5-3-2-4-6-17)20(25)16-7-9-18(10-8-16)30(27,28)23-11-13-29-14-12-23/h2-10,22H,11-14H2,1H3