2-(4-bromanylphenoxy)-2-methyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-2-methyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]propanamide Openeye Name: 2-(4-bromophenoxy)-2-methyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]propanamide CAS Name: 2-(4-bromophenoxy)-2-methyl-N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]propanamide IUPAC Name: 2-(4-bromophenoxy)-2-methyl-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]propanamide Traditional Name: 2-(4-bromophenoxy)-N-[2-(4-mesylpiperazino)phenyl]-2-methyl-propionamide Formula: C21H26BrN3O4S MolecularWeight: 496.41784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C(=O)NC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3O4S/c1-21(2,29-17-10-8-16(22)9-11-17)20(26)23-18-6-4-5-7-19(18)24-12-14-25(15-13-24)30(3,27)28/h4-11H,12-15H2,1-3H3,(H,23,26)