4-(glutathion-S-yl)-fenclorim

4-(glutathion-<i>S</i>-yl)-fenclorim




Chemical Formula:
C20H21N5O6SCL
Molecular Weight:
494.929 Daltons
Monoisotopic Mass:
496.1057568969 Daltons
SMILES:
C(SC1(C=C(Cl)N=C(N=1)C2(C=CC=CC=2)))C(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O
InChI:
1S/C20H22ClN5O6S/c21-14-8-16(26-18(25-14)11-4-2-1-3-5-11)33-10-13(19(30)23-9-17(28)29)24-15(27)7-6-12(22)20(31)32/h1-5,8,12-13H,6-7,9-10,22H2,(H,23,30)(H,24,27)(H,28,29)(H,31,32)/p-1/t12-,13-/m0/s1
InChIKey:
ORMLEFSJTSCINS-STQMWFEESA-M

Databases
MetaCyc:  CPD-21192
PubChem (CID):  134820337