ethyl 5-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]oxymethyl]-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate

Systemtic Name: ethyl 5-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]oxymethyl]-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate Openeye Name: ethyl 5-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]oxymethyl]-2-oxo-1,3-dihydroimidazole-4-carboxylate CAS Name: 5-[[(2S)-2-benzamido-4-(methylthio)-1-oxobutoxy]methyl]-2-oxo-1,3-dihydroimidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(2S)-2-benzamido-4-methylsulfanylbutanoyl]oxymethyl]-2-oxo-1,3-dihydroimidazole-4-carboxylate Traditional Name: 5-[[(2S)-2-benzamido-4-(methylthio)butanoyl]oxymethyl]-2-keto-4-imidazoline-4-carboxylic acid ethyl ester Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N1)COC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N1)COC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H23N3O6S/c1-3-27-18(25)15-14(21-19(26)22-15)11-28-17(24)13(9-10-29-2)20-16(23)12-7-5-4-6-8-12/h4-8,13H,3,9-11H2,1-2H3,(H,20,23)(H2,21,22,26)/t13-/m0/s1