(2R)-2-[4-(1H-indol-3-yl)butanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[4-(1H-indol-3-yl)butanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[4-(1H-indol-3-yl)butanoylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[4-(1H-indol-3-yl)butanoylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[4-(1H-indol-3-yl)butanoylamino]-4-(methylthio)butyrate Formula: C17H21N2O3S- MolecularWeight: 333.42524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)CCCC1=CNC2=CC=CC=C21

Isomeric SMILES

CSCC[C@H](C(=O)[O-])NC(=O)CCCC1=CNC2=CC=CC=C21

InChI

InChI=1S/C17H22N2O3S/c1-23-10-9-15(17(21)22)19-16(20)8-4-5-12-11-18-14-7-3-2-6-13(12)14/h2-3,6-7,11,15,18H,4-5,8-10H2,1H3,(H,19,20)(H,21,22)/p-1/t15-/m1/s1