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

Systemtic Name: methyl 5-ethyl-2-[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(4-m-anisylpiperazino)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)OC)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)OC)C(=O)OC

InChI

InChI=1S/C22H29N3O4S/c1-4-18-13-19(22(27)29-3)21(30-18)23-20(26)15-25-10-8-24(9-11-25)14-16-6-5-7-17(12-16)28-2/h5-7,12-13H,4,8-11,14-15H2,1-3H3,(H,23,26)