ethyl 4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: ethyl 4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylbenzoate Openeye Name: ethyl 4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[[4-(2-pyrazinyl)-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-pyrazin-2-ylpiperazino)sulfonylbenzoic acid ethyl ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O4S/c1-2-25-17(22)14-3-5-15(6-4-14)26(23,24)21-11-9-20(10-12-21)16-13-18-7-8-19-16/h3-8,13H,2,9-12H2,1H3