[6-azanyl-3-(1,3-benzothiazol-2-yl)-2-chloranyl-phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [6-azanyl-3-(1,3-benzothiazol-2-yl)-2-chloranyl-phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [6-amino-3-(1,3-benzothiazol-2-yl)-2-chloro-phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [6-amino-3-(1,3-benzothiazol-2-yl)-2-chlorophenyl] ester IUPAC Name: [6-amino-3-(1,3-benzothiazol-2-yl)-2-chlorophenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [6-amino-3-(1,3-benzothiazol-2-yl)-2-chloro-phenyl] ester Formula: C14H8ClF3N2O3S2 MolecularWeight: 408.80313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C(=C(C=C3)N)OS(=O)(=O)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C(=C(C=C3)N)OS(=O)(=O)C(F)(F)F)Cl

InChI

InChI=1S/C14H8ClF3N2O3S2/c15-11-7(13-20-9-3-1-2-4-10(9)24-13)5-6-8(19)12(11)23-25(21,22)14(16,17)18/h1-6H,19H2