(3-propan-2-ylphenyl) 2-[[(4R)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-4-yl]methylsulfanyl]benzoate

Systemtic Name: (3-propan-2-ylphenyl) 2-[[(4R)-4-methyl-2,5-bis(oxidanylidene)imidazolidin-4-yl]methylsulfanyl]benzoate Openeye Name: (3-isopropylphenyl) 2-[[(4R)-4-methyl-2,5-dioxo-imidazolidin-4-yl]methylsulfanyl]benzoate CAS Name: 2-[[(4R)-4-methyl-2,5-dioxo-4-imidazolidinyl]methylthio]benzoic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 2-[[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]methylsulfanyl]benzoate Traditional Name: 2-[[(4R)-2,5-diketo-4-methyl-imidazolidin-4-yl]methylthio]benzoic acid m-cumenyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2SCC3(C(=O)NC(=O)N3)C

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2SC[C@]3(C(=O)NC(=O)N3)C

InChI

InChI=1S/C21H22N2O4S/c1-13(2)14-7-6-8-15(11-14)27-18(24)16-9-4-5-10-17(16)28-12-21(3)19(25)22-20(26)23-21/h4-11,13H,12H2,1-3H3,(H2,22,23,25,26)/t21-/m0/s1