ethyl 4-[4-(5-methylpyrazin-2-yl)carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(5-methylpyrazin-2-yl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[(5-methyl-2-pyrazinyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(5-methylpyrazinoyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C19H22N4O5S/c1-3-28-19(25)15-4-6-16(7-5-15)29(26,27)23-10-8-22(9-11-23)18(24)17-13-20-14(2)12-21-17/h4-7,12-13H,3,8-11H2,1-2H3