methyl 2-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate

Systemtic Name: methyl 2-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Openeye Name: methyl 2-[(2-chloro-6-fluoro-benzoyl)amino]-4,5-dihydrobenzo[e]benzothiophene-1-carboxylate CAS Name: 2-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-6-fluorobenzoyl)amino]-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Traditional Name: 2-[(2-chloro-6-fluoro-benzoyl)amino]-4,5-dihydrobenzo[e]benzothiophene-1-carboxylic acid methyl ester Formula: C21H15ClFNO3S MolecularWeight: 415.865103

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1C3=CC=CC=C3CC2)NC(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

COC(=O)C1=C(SC2=C1C3=CC=CC=C3CC2)NC(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H15ClFNO3S/c1-27-21(26)18-16-12-6-3-2-5-11(12)9-10-15(16)28-20(18)24-19(25)17-13(22)7-4-8-14(17)23/h2-8H,9-10H2,1H3,(H,24,25)