methyl (4R,5S)-5-(4-methylphenyl)-1-(phenylsulfonyl)-4,5-dihydroimidazole-4-carboxylate

Systemtic Name: methyl (4R,5S)-5-(4-methylphenyl)-1-(phenylsulfonyl)-4,5-dihydroimidazole-4-carboxylate Openeye Name: methyl (4R,5S)-1-(benzenesulfonyl)-5-(p-tolyl)-4,5-dihydroimidazole-4-carboxylate CAS Name: (4R,5S)-1-(benzenesulfonyl)-5-(4-methylphenyl)-4,5-dihydroimidazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-1-(benzenesulfonyl)-5-(4-methylphenyl)-4,5-dihydroimidazole-4-carboxylate Traditional Name: (4R,5S)-1-besyl-5-(p-tolyl)-2-imidazoline-4-carboxylic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(N=CN2S(=O)(=O)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2[C@@H](N=CN2S(=O)(=O)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H18N2O4S/c1-13-8-10-14(11-9-13)17-16(18(21)24-2)19-12-20(17)25(22,23)15-6-4-3-5-7-15/h3-12,16-17H,1-2H3/t16-,17+/m1/s1