tert-butyl 3-[(2-bromophenyl)sulfanylmethyl]-4,4-dimethyl-5-oxidanyl-2-oxidanylidene-imidazolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(2-bromophenyl)sulfanylmethyl]-4,4-dimethyl-5-oxidanyl-2-oxidanylidene-imidazolidine-1-carboxylate Openeye Name: tert-butyl 3-[(2-bromophenyl)sulfanylmethyl]-5-hydroxy-4,4-dimethyl-2-oxo-imidazolidine-1-carboxylate CAS Name: 3-[[(2-bromophenyl)thio]methyl]-5-hydroxy-4,4-dimethyl-2-oxo-1-imidazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2-bromophenyl)sulfanylmethyl]-5-hydroxy-4,4-dimethyl-2-oxoimidazolidine-1-carboxylate Traditional Name: 3-[[(2-bromophenyl)thio]methyl]-5-hydroxy-2-keto-4,4-dimethyl-imidazolidine-1-carboxylic acid tert-butyl ester Formula: C17H23BrN2O4S MolecularWeight: 431.34452

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C(=O)N1CSC2=CC=CC=C2Br)C(=O)OC(C)(C)C)O)C

Isomeric SMILES

CC1(C(N(C(=O)N1CSC2=CC=CC=C2Br)C(=O)OC(C)(C)C)O)C

InChI

InChI=1S/C17H23BrN2O4S/c1-16(2,3)24-15(23)20-13(21)17(4,5)19(14(20)22)10-25-12-9-7-6-8-11(12)18/h6-9,13,21H,10H2,1-5H3