1-[(2R,5S)-5-(hydroxymethyl)-1-(4-methylphenyl)sulfonyl-pyrrolidin-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,5S)-5-(hydroxymethyl)-1-(4-methylphenyl)sulfonyl-pyrrolidin-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,5S)-5-(hydroxymethyl)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,5S)-5-(hydroxymethyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,5S)-5-(hydroxymethyl)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 5-methyl-1-[(2R,5S)-5-methylol-1-tosyl-pyrrolidin-2-yl]pyrimidine-2,4-quinone Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2N3C=C(C(=O)NC3=O)C)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CC[C@@H]2N3C=C(C(=O)NC3=O)C)CO

InChI

InChI=1S/C17H21N3O5S/c1-11-3-6-14(7-4-11)26(24,25)20-13(10-21)5-8-15(20)19-9-12(2)16(22)18-17(19)23/h3-4,6-7,9,13,15,21H,5,8,10H2,1-2H3,(H,18,22,23)/t13-,15+/m0/s1