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

Systemtic Name: methyl 2-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-(3,4-dichlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(3,4-dichlorophenyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C18H19Cl2N3O3S MolecularWeight: 428.33276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H19Cl2N3O3S/c1-26-18(25)13-4-9-27-17(13)21-16(24)11-22-5-7-23(8-6-22)12-2-3-14(19)15(20)10-12/h2-4,9-10H,5-8,11H2,1H3,(H,21,24)