ethyl 2-[2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]ethanoylamino]-4-(5-methylfuran-2-yl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]ethanoylamino]-4-(5-methylfuran-2-yl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]acetyl]amino]-4-(5-methyl-2-furyl)thiophene-3-carboxylate CAS Name: 2-[[2-[4-(2-cyanophenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]amino]-4-(5-methyl-2-furanyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]acetyl]amino]-4-(5-methylfuran-2-yl)thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(2-cyanophenyl)sulfonylpiperazino]acetyl]amino]-4-(5-methyl-2-furyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H26N4O6S2 MolecularWeight: 542.62714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(O2)C)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(O2)C)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H26N4O6S2/c1-3-34-25(31)23-19(20-9-8-17(2)35-20)16-36-24(23)27-22(30)15-28-10-12-29(13-11-28)37(32,33)21-7-5-4-6-18(21)14-26/h4-9,16H,3,10-13,15H2,1-2H3,(H,27,30)