methyl 3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylthiophene-2-carboxylate

Systemtic Name: methyl 3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylthiophene-2-carboxylate Openeye Name: methyl 3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylthiophene-2-carboxylate CAS Name: 3-[[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylthiophene-2-carboxylate Traditional Name: 3-[4-(2-naphthoyl)piperazino]sulfonylthiophene-2-carboxylic acid methyl ester Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H20N2O5S2/c1-28-21(25)19-18(8-13-29-19)30(26,27)23-11-9-22(10-12-23)20(24)17-7-6-15-4-2-3-5-16(15)14-17/h2-8,13-14H,9-12H2,1H3