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

Systemtic Name: ethyl 4,5-dimethyl-2-[[3-[4-(2-phenylethenyl)piperazin-1-yl]quinoxalin-2-yl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[3-(4-styrylpiperazin-1-yl)quinoxalin-2-yl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[3-[4-(2-phenylethenyl)-1-piperazinyl]-2-quinoxalinyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[3-[4-(2-phenylethenyl)piperazin-1-yl]quinoxalin-2-yl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[3-(4-styrylpiperazino)quinoxalin-2-yl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C29H31N5O2S MolecularWeight: 513.65374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C=CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C=CC5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2S/c1-4-36-29(35)25-20(2)21(3)37-28(25)32-26-27(31-24-13-9-8-12-23(24)30-26)34-18-16-33(17-19-34)15-14-22-10-6-5-7-11-22/h5-15H,4,16-19H2,1-3H3,(H,30,32)