N-[4-[4-[2-(4-bromanylphenoxy)ethanoyl]piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[4-[2-(4-bromanylphenoxy)ethanoyl]piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[4-[2-(4-bromophenoxy)acetyl]piperazin-1-yl]sulfonylphenyl]acetamide CAS Name: N-[4-[[4-[2-(4-bromophenoxy)-1-oxoethyl]-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[4-[2-(4-bromophenoxy)acetyl]piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[4-[2-(4-bromophenoxy)acetyl]piperazino]sulfonylphenyl]acetamide Formula: C20H22BrN3O5S MolecularWeight: 496.37478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O5S/c1-15(25)22-17-4-8-19(9-5-17)30(27,28)24-12-10-23(11-13-24)20(26)14-29-18-6-2-16(21)3-7-18/h2-9H,10-14H2,1H3,(H,22,25)