[2-[(5-fluoranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(5-fluoranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-(thiophen-2-ylmethyl)azanium Openeye Name: allyl-[2-(5-fluoro-2-methyl-anilino)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: [2-(5-fluoro-2-methylanilino)-2-oxoethyl]-prop-2-enyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-(5-fluoro-2-methylanilino)-2-oxoethyl]-prop-2-enyl-(thiophen-2-ylmethyl)azanium Traditional Name: allyl-[2-(5-fluoro-2-methyl-anilino)-2-keto-ethyl]-(2-thenyl)ammonium Formula: C17H20FN2OS+ MolecularWeight: 319.416903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)C[NH+](CC=C)CC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)C[NH+](CC=C)CC2=CC=CS2

InChI

InChI=1S/C17H19FN2OS/c1-3-8-20(11-15-5-4-9-22-15)12-17(21)19-16-10-14(18)7-6-13(16)2/h3-7,9-10H,1,8,11-12H2,2H3,(H,19,21)/p+1