ethyl 2-[[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[3-(4-ethyl-1-piperazinyl)-2-quinoxalinyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(4-ethylpiperazino)quinoxalin-2-yl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C28H31N5O2S MolecularWeight: 501.64304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=CC=CC=C3N=C2NC4=C(C(=CS4)C5=CC=C(C=C5)C)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=CC=CC=C3N=C2NC4=C(C(=CS4)C5=CC=C(C=C5)C)C(=O)OCC

InChI

InChI=1S/C28H31N5O2S/c1-4-32-14-16-33(17-15-32)26-25(29-22-8-6-7-9-23(22)30-26)31-27-24(28(34)35-5-2)21(18-36-27)20-12-10-19(3)11-13-20/h6-13,18H,4-5,14-17H2,1-3H3,(H,29,31)