[4-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxidanylidene-ethyl]-6,7-dihydro-5H-thieno[3,2-b]pyridin-2-yl] 2-acetyloxybenzoate

Systemtic Name: [4-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxidanylidene-ethyl]-6,7-dihydro-5H-thieno[3,2-b]pyridin-2-yl] 2-acetyloxybenzoate Openeye Name: [4-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxo-ethyl]-6,7-dihydro-5H-thieno[3,2-b]pyridin-2-yl] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [4-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-6,7-dihydro-5H-thieno[3,2-b]pyridin-2-yl] ester IUPAC Name: [4-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-6,7-dihydro-5H-thieno[3,2-b]pyridin-2-yl] 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [4-[2-cyclopropyl-1-(2-fluorophenyl)-2-keto-ethyl]-6,7-dihydro-5H-thieno[3,2-b]pyridin-2-yl] ester Formula: C27H24FNO5S MolecularWeight: 493.546563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OC2=CC3=C(S2)CCCN3C(C4=CC=CC=C4F)C(=O)C5CC5

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OC2=CC3=C(S2)CCCN3C(C4=CC=CC=C4F)C(=O)C5CC5

InChI

InChI=1S/C27H24FNO5S/c1-16(30)33-22-10-5-3-8-19(22)27(32)34-24-15-21-23(35-24)11-6-14-29(21)25(26(31)17-12-13-17)18-7-2-4-9-20(18)28/h2-5,7-10,15,17,25H,6,11-14H2,1H3