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

Systemtic Name: ethyl 2-[2-[4-(4-ethoxycarbonylphenyl)sulfonylpiperazin-1-yl]ethanoylamino]-4-(5-methylfuran-2-yl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(4-ethoxycarbonylphenyl)sulfonylpiperazin-1-yl]acetyl]amino]-4-(5-methyl-2-furyl)thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-ethoxycarbonylphenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]amino]-4-(5-methyl-2-furanyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-ethoxycarbonylphenyl)sulfonylpiperazin-1-yl]acetyl]amino]-4-(5-methylfuran-2-yl)thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(4-carbethoxyphenyl)sulfonylpiperazino]acetyl]amino]-4-(5-methyl-2-furyl)thiophene-3-carboxylic acid ethyl ester Formula: C27H31N3O8S2 MolecularWeight: 589.68034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=CS3)C4=CC=C(O4)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=CS3)C4=CC=C(O4)C)C(=O)OCC

InChI

InChI=1S/C27H31N3O8S2/c1-4-36-26(32)19-7-9-20(10-8-19)40(34,35)30-14-12-29(13-15-30)16-23(31)28-25-24(27(33)37-5-2)21(17-39-25)22-11-6-18(3)38-22/h6-11,17H,4-5,12-16H2,1-3H3,(H,28,31)