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

Systemtic Name: ethyl 2-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(4-methoxyphenyl)sulfonylpiperazino]acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H29N3O6S2 MolecularWeight: 543.65496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H29N3O6S2/c1-3-35-26(31)22-17-23(19-7-5-4-6-8-19)36-25(22)27-24(30)18-28-13-15-29(16-14-28)37(32,33)21-11-9-20(34-2)10-12-21/h4-12,17H,3,13-16,18H2,1-2H3,(H,27,30)