(2R)-3-(1H-indol-3-yl)-2-(3-methylsulfanylpropanoylamino)propanoate

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-(3-methylsulfanylpropanoylamino)propanoate Openeye Name: (2R)-3-(1H-indol-3-yl)-2-(3-methylsulfanylpropanoylamino)propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[3-(methylthio)-1-oxopropyl]amino]propanoate IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-(3-methylsulfanylpropanoylamino)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[3-(methylthio)propanoylamino]propionate Formula: C15H17N2O3S- MolecularWeight: 305.37208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CSCCC(=O)N[C@H](CC1=CNC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C15H18N2O3S/c1-21-7-6-14(18)17-13(15(19)20)8-10-9-16-12-5-3-2-4-11(10)12/h2-5,9,13,16H,6-8H2,1H3,(H,17,18)(H,19,20)/p-1/t13-/m1/s1