methyl (2R)-3-(1H-indol-3-yl)-2-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[1-(3-pyridylsulfonyl)isonipecotoyl]amino]propionic acid methyl ester Formula: C23H26N4O5S MolecularWeight: 470.54134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H26N4O5S/c1-32-23(29)21(13-17-14-25-20-7-3-2-6-19(17)20)26-22(28)16-8-11-27(12-9-16)33(30,31)18-5-4-10-24-15-18/h2-7,10,14-16,21,25H,8-9,11-13H2,1H3,(H,26,28)/t21-/m1/s1