2-[4-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperazin-1-yl]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[4-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperazin-1-yl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[4-(4-bromo-2-ethyl-phenyl)sulfonylpiperazin-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[4-(4-bromo-2-ethylphenyl)sulfonyl-1-piperazinyl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[4-(4-bromo-2-ethylphenyl)sulfonylpiperazin-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[4-(4-bromo-2-ethyl-phenyl)sulfonylpiperazino]-N-methyl-N-phenyl-acetamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)CC(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)CC(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O3S/c1-3-17-15-18(22)9-10-20(17)29(27,28)25-13-11-24(12-14-25)16-21(26)23(2)19-7-5-4-6-8-19/h4-10,15H,3,11-14,16H2,1-2H3