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

Systemtic Name: methyl 2-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(3,4-dichlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(3,4-dichlorophenyl)piperazino]acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C20H23Cl2N3O3S MolecularWeight: 456.38592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23Cl2N3O3S/c1-3-14-11-15(20(27)28-2)19(29-14)23-18(26)12-24-6-8-25(9-7-24)13-4-5-16(21)17(22)10-13/h4-5,10-11H,3,6-9,12H2,1-2H3,(H,23,26)