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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S/c1-4-18-14-19(22(27)29-5-2)21(30-18)23-20(26)15-24-9-11-25(12-10-24)16-7-6-8-17(13-16)28-3/h6-8,13-14H,4-5,9-12,15H2,1-3H3,(H,23,26)