ethyl 3-[[ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[[ethyl-[2-(ethylamino)-2-oxo-ethyl]amino]methyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[ethyl-[2-(ethylamino)-2-oxoethyl]amino]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[ethyl-[2-(ethylamino)-2-oxoethyl]amino]methyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[[ethyl-[2-(ethylamino)-2-keto-ethyl]amino]methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C18H23FN2O3S MolecularWeight: 366.450223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN(CC)CC1=C(SC2=CC=CC(=C21)F)C(=O)OCC

Isomeric SMILES

CCNC(=O)CN(CC)CC1=C(SC2=CC=CC(=C21)F)C(=O)OCC

InChI

InChI=1S/C18H23FN2O3S/c1-4-20-15(22)11-21(5-2)10-12-16-13(19)8-7-9-14(16)25-17(12)18(23)24-6-3/h7-9H,4-6,10-11H2,1-3H3,(H,20,22)