[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: [(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: [(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid [(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H24FNO4S MolecularWeight: 393.472263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)OC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

InChI

InChI=1S/C20H24FNO4S/c1-12(19(23)22-13-7-4-3-5-8-13)26-20(24)18-14(11-25-2)17-15(21)9-6-10-16(17)27-18/h6,9-10,12-13H,3-5,7-8,11H2,1-2H3,(H,22,23)/t12-/m1/s1