1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-(2,6-dimethylphenoxy)ethanone IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-2-(2,6-dimethylphenoxy)ethanone Formula: C18H21BrN2O4S2 MolecularWeight: 473.40434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H21BrN2O4S2/c1-13-4-3-5-14(2)18(13)25-12-16(22)20-8-10-21(11-9-20)27(23,24)17-7-6-15(19)26-17/h3-7H,8-12H2,1-2H3