(phenylmethyl) 2-azanyl-5-oxidanylidene-4-[(phenylmethylsulfanyl)methyl]-4H-imidazole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-azanyl-5-oxidanylidene-4-[(phenylmethylsulfanyl)methyl]-4H-imidazole-3-carboxylate Openeye Name: benzyl 2-amino-4-(benzylsulfanylmethyl)-5-oxo-4H-imidazole-3-carboxylate CAS Name: 2-amino-5-oxo-4-[(phenylmethylthio)methyl]-4H-imidazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-4-(benzylsulfanylmethyl)-5-oxo-4H-imidazole-3-carboxylate Traditional Name: 2-amino-5-[(benzylthio)methyl]-4-keto-2-imidazoline-1-carboxylic acid benzyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C(C(=O)N=C2N)CSCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C(C(=O)N=C2N)CSCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O3S/c20-18-21-17(23)16(13-26-12-15-9-5-2-6-10-15)22(18)19(24)25-11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H2,20,21,23)