4-(2-ethoxyphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(2-ethoxyphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butan-1-one Openeye Name: 4-(2-ethoxyphenoxy)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]butan-1-one CAS Name: 4-(2-ethoxyphenoxy)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(2-ethoxyphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)butan-1-one Traditional Name: 4-(2-ethoxyphenoxy)-1-[4-(2-thienylsulfonyl)piperazino]butan-1-one Formula: C20H26N2O5S2 MolecularWeight: 438.56084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H26N2O5S2/c1-2-26-17-7-3-4-8-18(17)27-15-5-9-19(23)21-11-13-22(14-12-21)29(24,25)20-10-6-16-28-20/h3-4,6-8,10,16H,2,5,9,11-15H2,1H3