methyl 4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonylbenzoate

Systemtic Name: methyl 4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonylbenzoate Openeye Name: methyl 4-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]benzoate CAS Name: 4-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]benzoate Traditional Name: 4-[4-(2-thenoyl)piperazine-1-carbonyl]benzoic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H18N2O4S/c1-24-18(23)14-6-4-13(5-7-14)16(21)19-8-10-20(11-9-19)17(22)15-3-2-12-25-15/h2-7,12H,8-11H2,1H3