{"PropertyTable":{"Properties":[{"CID":5362422,"MolecularFormula":"C23H31N3O4S2","MolecularWeight":"477.6","SMILES":"CC(C)C[C@H]([C@H](CSC1=CC=CS1)C(=O)NO)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC","ConnectivitySMILES":"CC(C)CC(C(CSC1=CC=CS1)C(=O)NO)C(=O)NC(CC2=CC=CC=C2)C(=O)NC","InChI":"InChI=1S/C23H31N3O4S2/c1-15(2)12-17(18(22(28)26-30)14-32-20-10-7-11-31-20)21(27)25-19(23(29)24-3)13-16-8-5-4-6-9-16/h4-11,15,17-19,30H,12-14H2,1-3H3,(H,24,29)(H,25,27)(H,26,28)/t17-,18+,19+/m1/s1","InChIKey":"XFILPEOLDIKJHX-QYZOEREBSA-N","ExactMass":"477.17559883","MonoisotopicMass":"477.17559883","TPSA":161,"Charge":0,"HBondDonorCount":4,"HBondAcceptorCount":6,"RotatableBondCount":12,"HeavyAtomCount":32,"Title":"Batimastat"}]}}