ethyl 5-[4-(6-pyrazol-1-ylpyrazin-2-yl)piperazin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-(6-pyrazol-1-ylpyrazin-2-yl)piperazin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[4-(6-pyrazol-1-ylpyrazin-2-yl)piperazin-1-yl]sulfonylfuran-2-carboxylate CAS Name: 5-[[4-[6-(1-pyrazolyl)-2-pyrazinyl]-1-piperazinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(6-pyrazol-1-ylpyrazin-2-yl)piperazin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-(6-pyrazol-1-ylpyrazin-2-yl)piperazino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C18H20N6O5S MolecularWeight: 432.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C3=NC(=CN=C3)N4C=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C3=NC(=CN=C3)N4C=CC=N4

InChI

InChI=1S/C18H20N6O5S/c1-2-28-18(25)14-4-5-17(29-14)30(26,27)23-10-8-22(9-11-23)15-12-19-13-16(21-15)24-7-3-6-20-24/h3-7,12-13H,2,8-11H2,1H3