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

Systemtic Name: methyl 2-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethanoylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(3,4-dichlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(3,4-dichlorophenyl)piperazino]acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H25Cl2N3O3S MolecularWeight: 470.4125

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C21H25Cl2N3O3S/c1-4-15-13(2)30-20(19(15)21(28)29-3)24-18(27)12-25-7-9-26(10-8-25)14-5-6-16(22)17(23)11-14/h5-6,11H,4,7-10,12H2,1-3H3,(H,24,27)