2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-N-(3,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-N-(3,4-dimethoxyphenyl)acetamide Formula: C18H22BrN3O5S2 MolecularWeight: 504.41838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)OC

InChI

InChI=1S/C18H22BrN3O5S2/c1-26-14-4-3-13(11-15(14)27-2)20-17(23)12-21-7-9-22(10-8-21)29(24,25)18-6-5-16(19)28-18/h3-6,11H,7-10,12H2,1-2H3,(H,20,23)