1-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]phenyl]sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]phenyl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[(5-methyl-2-phenyl-oxazol-4-yl)methylsulfanyl]phenyl]sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[4-[(5-methyl-2-phenyl-4-oxazolyl)methylthio]phenyl]sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]phenyl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[(5-methyl-2-phenyl-oxazol-4-yl)methylthio]phenyl]sulfonylproline Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CSC3=CC=C(C=C3)S(=O)(=O)N4CCCC4C(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CSC3=CC=C(C=C3)S(=O)(=O)N4CCCC4C(=O)O

InChI

InChI=1S/C22H22N2O5S2/c1-15-19(23-21(29-15)16-6-3-2-4-7-16)14-30-17-9-11-18(12-10-17)31(27,28)24-13-5-8-20(24)22(25)26/h2-4,6-7,9-12,20H,5,8,13-14H2,1H3,(H,25,26)