diethyl-[2-[(6-fluoranyl-1,3-benzothiazol-2-yl)-(2-phenylethanoyl)amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(6-fluoranyl-1,3-benzothiazol-2-yl)-(2-phenylethanoyl)amino]ethyl]azanium Openeye Name: diethyl-[2-[(6-fluoro-1,3-benzothiazol-2-yl)-(2-phenylacetyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(6-fluoro-1,3-benzothiazol-2-yl)-(1-oxo-2-phenylethyl)amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(6-fluoro-1,3-benzothiazol-2-yl)-(2-phenylacetyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(6-fluoro-1,3-benzothiazol-2-yl)-(2-phenylacetyl)amino]ethyl]ammonium Formula: C21H25FN3OS+ MolecularWeight: 386.506103

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24FN3OS/c1-3-24(4-2)12-13-25(20(26)14-16-8-6-5-7-9-16)21-23-18-11-10-17(22)15-19(18)27-21/h5-11,15H,3-4,12-14H2,1-2H3/p+1