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

Systemtic Name: ethyl 5-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 3-methyl-5-[[2-(4-veratrylpiperazino)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C23H31N3O5S/c1-5-31-23(28)22-16(2)12-21(32-22)24-20(27)15-26-10-8-25(9-11-26)14-17-6-7-18(29-3)19(13-17)30-4/h6-7,12-13H,5,8-11,14-15H2,1-4H3,(H,24,27)