2-[(1S)-1-(2-chloranyl-6-fluoranyl-phenyl)-2-nitro-ethyl]sulfanylaniline

Systemtic Name: 2-[(1S)-1-(2-chloranyl-6-fluoranyl-phenyl)-2-nitro-ethyl]sulfanylaniline Openeye Name: 2-[(1S)-1-(2-chloro-6-fluoro-phenyl)-2-nitro-ethyl]sulfanylaniline CAS Name: 2-[[(1S)-1-(2-chloro-6-fluorophenyl)-2-nitroethyl]thio]aniline IUPAC Name: 2-[(1S)-1-(2-chloro-6-fluorophenyl)-2-nitroethyl]sulfanylaniline Traditional Name: [2-[[(1S)-1-(2-chloro-6-fluoro-phenyl)-2-nitro-ethyl]thio]phenyl]amine Formula: C14H12ClFN2O2S MolecularWeight: 326.773683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)SC(C[N+](=O)[O-])C2=C(C=CC=C2Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)N)S[C@H](C[N+](=O)[O-])C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H12ClFN2O2S/c15-9-4-3-5-10(16)14(9)13(8-18(19)20)21-12-7-2-1-6-11(12)17/h1-7,13H,8,17H2/t13-/m1/s1