propan-2-yl 3-(4-methylphenyl)-3-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(4-methylphenyl)-3-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate Openeye Name: isopropyl 3-(p-tolyl)-3-[[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 3-(4-methylphenyl)-3-[[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(4-methylphenyl)-3-[(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)amino]propanoate Traditional Name: 3-(p-tolyl)-3-[[1-(3-pyridylsulfonyl)isonipecotoyl]amino]propionic acid isopropyl ester Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C24H31N3O5S/c1-17(2)32-23(28)15-22(19-8-6-18(3)7-9-19)26-24(29)20-10-13-27(14-11-20)33(30,31)21-5-4-12-25-16-21/h4-9,12,16-17,20,22H,10-11,13-15H2,1-3H3,(H,26,29)