[2-[(6-methoxypyridin-3-yl)amino]-2-oxidanylidene-ethyl] (2R)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate

Systemtic Name: [2-[(6-methoxypyridin-3-yl)amino]-2-oxidanylidene-ethyl] (2R)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate Openeye Name: [2-[(6-methoxy-3-pyridyl)amino]-2-oxo-ethyl] (2R)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate CAS Name: (2R)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]butanoic acid [2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-methoxypyridin-3-yl)amino]-2-oxoethyl] (2R)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate Traditional Name: (2R)-3-methyl-2-(p-toluoylamino)butyric acid [2-keto-2-[(6-methoxy-3-pyridyl)amino]ethyl] ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)OCC(=O)NC2=CN=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H](C(C)C)C(=O)OCC(=O)NC2=CN=C(C=C2)OC

InChI

InChI=1S/C21H25N3O5/c1-13(2)19(24-20(26)15-7-5-14(3)6-8-15)21(27)29-12-17(25)23-16-9-10-18(28-4)22-11-16/h5-11,13,19H,12H2,1-4H3,(H,23,25)(H,24,26)/t19-/m1/s1