3-bromanyl-N-[2-[(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-bromo-N-[2-[(6-fluorothiochroman-4-yl)amino]-2-oxo-ethyl]benzamide CAS Name: 3-bromo-N-[2-[(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]-2-oxoethyl]benzamide IUPAC Name: 3-bromo-N-[2-[(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)amino]-2-oxoethyl]benzamide Traditional Name: 3-bromo-N-[2-[(6-fluorothiochroman-4-yl)amino]-2-keto-ethyl]benzamide Formula: C18H16BrFN2O2S MolecularWeight: 423.299243

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)CNC(=O)C3=CC(=CC=C3)Br)C=C(C=C2)F

Isomeric SMILES

C1CSC2=C(C1NC(=O)CNC(=O)C3=CC(=CC=C3)Br)C=C(C=C2)F

InChI

InChI=1S/C18H16BrFN2O2S/c19-12-3-1-2-11(8-12)18(24)21-10-17(23)22-15-6-7-25-16-5-4-13(20)9-14(15)16/h1-5,8-9,15H,6-7,10H2,(H,21,24)(H,22,23)