ethyl 3-[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[4-(2,5-dimethoxybenzyl)piperazino]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C28H33N3O5S MolecularWeight: 523.64372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)CC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)CC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C28H33N3O5S/c1-4-36-28(33)27-23(17-25(37-27)20-8-6-5-7-9-20)29-26(32)19-31-14-12-30(13-15-31)18-21-16-22(34-2)10-11-24(21)35-3/h5-11,16-17H,4,12-15,18-19H2,1-3H3,(H,29,32)