N-[(1S)-1-[2,4-bis(fluoranyl)phenyl]ethyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1S)-1-[2,4-bis(fluoranyl)phenyl]ethyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(1S)-1-(2,4-difluorophenyl)ethyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(1S)-1-(2,4-difluorophenyl)ethyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1S)-1-(2,4-difluorophenyl)ethyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(1S)-1-(2,4-difluorophenyl)ethyl]-5-nitro-benzothiophene-2-carboxamide Formula: C17H12F2N2O3S MolecularWeight: 362.350586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)F)F)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)F)F)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12F2N2O3S/c1-9(13-4-2-11(18)8-14(13)19)20-17(22)16-7-10-6-12(21(23)24)3-5-15(10)25-16/h2-9H,1H3,(H,20,22)/t9-/m0/s1