(2R)-3-(4-hydroxyphenyl)-2-(phenylcarbamothioylamino)propanoate

Systemtic Name: (2R)-3-(4-hydroxyphenyl)-2-(phenylcarbamothioylamino)propanoate Openeye Name: (2R)-3-(4-hydroxyphenyl)-2-(phenylcarbamothioylamino)propanoate CAS Name: (2R)-2-[[anilino(sulfanylidene)methyl]amino]-3-(4-hydroxyphenyl)propanoate IUPAC Name: (2R)-3-(4-hydroxyphenyl)-2-(phenylcarbamothioylamino)propanoate Traditional Name: (2R)-3-(4-hydroxyphenyl)-2-(phenylthiocarbamoylamino)propionate Formula: C16H15N2O3S- MolecularWeight: 315.3669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC(CC2=CC=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/c19-13-8-6-11(7-9-13)10-14(15(20)21)18-16(22)17-12-4-2-1-3-5-12/h1-9,14,19H,10H2,(H,20,21)(H2,17,18,22)/p-1/t14-/m1/s1