(2R)-3-phenyl-2-[(4-sulfamoylphenyl)methylcarbamothioylamino]propanoic acid

Systemtic Name: (2R)-3-phenyl-2-[(4-sulfamoylphenyl)methylcarbamothioylamino]propanoic acid Openeye Name: (2R)-3-phenyl-2-[(4-sulfamoylphenyl)methylcarbamothioylamino]propanoic acid CAS Name: (2R)-3-phenyl-2-[[[(4-sulfamoylphenyl)methylamino]-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: (2R)-3-phenyl-2-[(4-sulfamoylphenyl)methylcarbamothioylamino]propanoic acid Traditional Name: (2R)-3-phenyl-2-[(4-sulfamoylbenzyl)thiocarbamoylamino]propionic acid Formula: C17H19N3O4S2 MolecularWeight: 393.48046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H19N3O4S2/c18-26(23,24)14-8-6-13(7-9-14)11-19-17(25)20-15(16(21)22)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2,(H,21,22)(H2,18,23,24)(H2,19,20,25)/t15-/m1/s1