[1-[4-[(2-azanyl-2-oxidanylidene-ethyl)-propan-2-yl-carbamoyl]-1,3-thiazol-2-yl]azetidin-3-yl] methanesulfonate

Systemtic Name: [1-[4-[(2-azanyl-2-oxidanylidene-ethyl)-propan-2-yl-carbamoyl]-1,3-thiazol-2-yl]azetidin-3-yl] methanesulfonate Openeye Name: [1-[4-[(2-amino-2-oxo-ethyl)-isopropyl-carbamoyl]thiazol-2-yl]azetidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [1-[4-[[(2-amino-2-oxoethyl)-propan-2-ylamino]-oxomethyl]-2-thiazolyl]-3-azetidinyl] ester IUPAC Name: [1-[4-[(2-amino-2-oxoethyl)-propan-2-ylcarbamoyl]-1,3-thiazol-2-yl]azetidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[4-[(2-amino-2-keto-ethyl)-isopropyl-carbamoyl]thiazol-2-yl]azetidin-3-yl] ester Formula: C13H20N4O5S2 MolecularWeight: 376.4517

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N)C(=O)C1=CSC(=N1)N2CC(C2)OS(=O)(=O)C

Isomeric SMILES

CC(C)N(CC(=O)N)C(=O)C1=CSC(=N1)N2CC(C2)OS(=O)(=O)C

InChI

InChI=1S/C13H20N4O5S2/c1-8(2)17(6-11(14)18)12(19)10-7-23-13(15-10)16-4-9(5-16)22-24(3,20)21/h7-9H,4-6H2,1-3H3,(H2,14,18)