(2R)-3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylcarbamoylamino]propanoic acid

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylcarbamoylamino]propanoic acid Openeye Name: (2R)-3-(1H-indol-3-yl)-2-(p-tolylsulfonylcarbamoylamino)propanoic acid CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]propanoic acid IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylcarbamoylamino]propanoic acid Traditional Name: (2R)-3-(1H-indol-3-yl)-2-(tosylcarbamoylamino)propionic acid Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C19H19N3O5S/c1-12-6-8-14(9-7-12)28(26,27)22-19(25)21-17(18(23)24)10-13-11-20-16-5-3-2-4-15(13)16/h2-9,11,17,20H,10H2,1H3,(H,23,24)(H2,21,22,25)/t17-/m1/s1