2-(1-methylsulfonyl-3-oxidanylidene-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl)ethanoic acid

Systemtic Name: 2-(1-methylsulfonyl-3-oxidanylidene-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl)ethanoic acid Openeye Name: 2-(2-isopropyl-1-methylsulfonyl-3-oxo-5-phenyl-2H-pyrazin-4-yl)acetic acid CAS Name: 2-(1-methylsulfonyl-3-oxo-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl)acetic acid IUPAC Name: 2-(1-methylsulfonyl-3-oxo-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl)acetic acid Traditional Name: 2-(2-isopropyl-3-keto-1-mesyl-5-phenyl-2H-pyrazin-4-yl)acetic acid Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C(=CN1S(=O)(=O)C)C2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC(C)C1C(=O)N(C(=CN1S(=O)(=O)C)C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C16H20N2O5S/c1-11(2)15-16(21)17(10-14(19)20)13(9-18(15)24(3,22)23)12-7-5-4-6-8-12/h4-9,11,15H,10H2,1-3H3,(H,19,20)