(phenylmethyl) 2-[ethylsulfonyl(pyridin-4-yl)amino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[ethylsulfonyl(pyridin-4-yl)amino]-3-methyl-butanoate Openeye Name: benzyl 2-[ethylsulfonyl(4-pyridyl)amino]-3-methyl-butanoate CAS Name: 2-[ethylsulfonyl(pyridin-4-yl)amino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[ethylsulfonyl(pyridin-4-yl)amino]-3-methylbutanoate Traditional Name: 2-[esyl(4-pyridyl)amino]-3-methyl-butyric acid benzyl ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(C1=CC=NC=C1)C(C(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)N(C1=CC=NC=C1)C(C(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2O4S/c1-4-26(23,24)21(17-10-12-20-13-11-17)18(15(2)3)19(22)25-14-16-8-6-5-7-9-16/h5-13,15,18H,4,14H2,1-3H3