(2S)-2-[(4-methylphenyl)sulfonylcarbamoylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(4-methylphenyl)sulfonylcarbamoylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-3-phenyl-2-(p-tolylsulfonylcarbamoylamino)propanoic acid CAS Name: (2S)-2-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(4-methylphenyl)sulfonylcarbamoylamino]-3-phenylpropanoic acid Traditional Name: (2S)-3-phenyl-2-(tosylcarbamoylamino)propionic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H18N2O5S/c1-12-7-9-14(10-8-12)25(23,24)19-17(22)18-15(16(20)21)11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3,(H,20,21)(H2,18,19,22)/t15-/m0/s1