[2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-phenyl-ethyl] methanesulfonate

Systemtic Name: [2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-phenyl-ethyl] methanesulfonate Openeye Name: [2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-phenyl-ethyl] methanesulfonate CAS Name: methanesulfonic acid [2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-phenylethyl] ester IUPAC Name: [2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-phenylethyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-1-phenyl-ethyl] ester Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CNC1=NS(=O)(=O)C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OC(CNC1=NS(=O)(=O)C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O5S2/c1-24(19,20)23-14(12-7-3-2-4-8-12)11-17-16-13-9-5-6-10-15(13)25(21,22)18-16/h2-10,14H,11H2,1H3,(H,17,18)