N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-8-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-8-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-8-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-8-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-8-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(2-chloro-6-fluoro-benzyl)-8-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C21H17ClFNO2S MolecularWeight: 401.881583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC3=C2SC(=C3)C(=O)NCC4=C(C=CC=C4Cl)F)C=C1

Isomeric SMILES

COC1=CC2=C(CCC3=C2SC(=C3)C(=O)NCC4=C(C=CC=C4Cl)F)C=C1

InChI

InChI=1S/C21H17ClFNO2S/c1-26-14-8-7-12-5-6-13-9-19(27-20(13)15(12)10-14)21(25)24-11-16-17(22)3-2-4-18(16)23/h2-4,7-10H,5-6,11H2,1H3,(H,24,25)