(phenylmethyl) 4-ethyl-2,6-dimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate

Systemtic Name: (phenylmethyl) 4-ethyl-2,6-dimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate Openeye Name: benzyl 4-ethyl-2,6-dimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate CAS Name: 4-ethyl-2,6-dimethyl-1-methylsulfonyl-5-[oxo-[[(1R)-1-phenylethyl]amino]methyl]-4H-pyridine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-ethyl-2,6-dimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate Traditional Name: 4-ethyl-1-mesyl-2,6-dimethyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylic acid benzyl ester Formula: C27H32N2O5S MolecularWeight: 496.61838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(N(C(=C1C(=O)OCC2=CC=CC=C2)C)S(=O)(=O)C)C)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCC1C(=C(N(C(=C1C(=O)OCC2=CC=CC=C2)C)S(=O)(=O)C)C)C(=O)N[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O5S/c1-6-23-24(26(30)28-18(2)22-15-11-8-12-16-22)19(3)29(35(5,32)33)20(4)25(23)27(31)34-17-21-13-9-7-10-14-21/h7-16,18,23H,6,17H2,1-5H3,(H,28,30)/t18-,23?/m1/s1