5-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-4-oxidanyl-pentanoic acid

Systemtic Name: 5-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-4-oxidanyl-pentanoic acid Openeye Name: 5-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]pentanoic acid CAS Name: 5-[(4,6-dimethyl-2-pyrimidinyl)thio]-4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]pentanoic acid IUPAC Name: 5-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]pentanoic acid Traditional Name: 5-[(4,6-dimethylpyrimidin-2-yl)thio]-4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]valeric acid Formula: C24H27N3O6S2 MolecularWeight: 517.61768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC)O)C

InChI

InChI=1S/C24H27N3O6S2/c1-15-12-16(2)26-24(25-15)34-14-19(28)13-22(23(29)30)27-35(31,32)21-10-6-18(7-11-21)17-4-8-20(33-3)9-5-17/h4-12,19,22,27-28H,13-14H2,1-3H3,(H,29,30)