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

Systemtic Name: (phenylmethyl) 2,4,6-trimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate Openeye Name: benzyl 2,4,6-trimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate CAS Name: 2,4,6-trimethyl-1-methylsulfonyl-5-[oxo-[[(1R)-1-phenylethyl]amino]methyl]-4H-pyridine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2,4,6-trimethyl-1-methylsulfonyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylate Traditional Name: 1-mesyl-2,4,6-trimethyl-5-[[(1R)-1-phenylethyl]carbamoyl]-4H-pyridine-3-carboxylic acid benzyl ester Formula: C26H30N2O5S MolecularWeight: 482.5918

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=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

CC1C(=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/C26H30N2O5S/c1-17-23(25(29)27-18(2)22-14-10-7-11-15-22)19(3)28(34(5,31)32)20(4)24(17)26(30)33-16-21-12-8-6-9-13-21/h6-15,17-18H,16H2,1-5H3,(H,27,29)/t17?,18-/m1/s1