methyl 2-[[3-[4-(2-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[3-[4-(2-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[3-[4-(2-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-[4-(2-fluorophenyl)-1-piperazinyl]-2-quinoxalinyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-[4-(2-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-[4-(2-fluorophenyl)piperazino]quinoxalin-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C26H26FN5O2S MolecularWeight: 491.580343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C5=CC=CC=C5F)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C5=CC=CC=C5F)C

InChI

InChI=1S/C26H26FN5O2S/c1-16-17(2)35-25(22(16)26(33)34-3)30-23-24(29-20-10-6-5-9-19(20)28-23)32-14-12-31(13-15-32)21-11-7-4-8-18(21)27/h4-11H,12-15H2,1-3H3,(H,28,30)