methyl 2-(butylsulfonylamino)-4-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate

Systemtic Name: methyl 2-(butylsulfonylamino)-4-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate Openeye Name: methyl 2-(butylsulfonylamino)-4-[4-[4-(4-pyridyl)piperazin-1-yl]phenoxy]butanoate CAS Name: 2-(butylsulfonylamino)-4-[4-(4-pyridin-4-yl-1-piperazinyl)phenoxy]butanoic acid methyl ester IUPAC Name: methyl 2-(butylsulfonylamino)-4-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate Traditional Name: 2-(butylsulfonylamino)-4-[4-[4-(4-pyridyl)piperazino]phenoxy]butyric acid methyl ester Formula: C24H34N4O5S MolecularWeight: 490.61556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CCOC1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3)C(=O)OC

Isomeric SMILES

CCCCS(=O)(=O)NC(CCOC1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3)C(=O)OC

InChI

InChI=1S/C24H34N4O5S/c1-3-4-19-34(30,31)26-23(24(29)32-2)11-18-33-22-7-5-20(6-8-22)27-14-16-28(17-15-27)21-9-12-25-13-10-21/h5-10,12-13,23,26H,3-4,11,14-19H2,1-2H3