(2S)-1-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ylsulfonylphenyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ylsulfonylphenyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(3-morpholinosulfonylphenyl)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-N-[3-(4-morpholinylsulfonyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ylsulfonylphenyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(3-morpholinosulfonylphenyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C22H27N3O6S2 MolecularWeight: 493.59628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H27N3O6S2/c1-17-7-9-19(10-8-17)33(29,30)25-11-3-6-21(25)22(26)23-18-4-2-5-20(16-18)32(27,28)24-12-14-31-15-13-24/h2,4-5,7-10,16,21H,3,6,11-15H2,1H3,(H,23,26)/t21-/m0/s1