[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C14H15BrFN2OS+ MolecularWeight: 358.249103

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C14H14BrFN2OS/c1-18(7-10-4-5-20-9-10)8-14(19)17-13-3-2-11(15)6-12(13)16/h2-6,9H,7-8H2,1H3,(H,17,19)/p+1