tert-butyl 2-[4-(5-butylpyrazin-2-yl)piperazin-1-yl]sulfonylethanoate

Systemtic Name: tert-butyl 2-[4-(5-butylpyrazin-2-yl)piperazin-1-yl]sulfonylethanoate Openeye Name: tert-butyl 2-[4-(5-butylpyrazin-2-yl)piperazin-1-yl]sulfonylacetate CAS Name: 2-[[4-(5-butyl-2-pyrazinyl)-1-piperazinyl]sulfonyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(5-butylpyrazin-2-yl)piperazin-1-yl]sulfonylacetate Traditional Name: 2-[4-(5-butylpyrazin-2-yl)piperazino]sulfonylacetic acid tert-butyl ester Formula: C18H30N4O4S MolecularWeight: 398.5202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=N1)N2CCN(CC2)S(=O)(=O)CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CN=C(C=N1)N2CCN(CC2)S(=O)(=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C18H30N4O4S/c1-5-6-7-15-12-20-16(13-19-15)21-8-10-22(11-9-21)27(24,25)14-17(23)26-18(2,3)4/h12-13H,5-11,14H2,1-4H3