1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(3-ethylphenoxy)ethanone

Systemtic Name: 1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(3-ethylphenoxy)ethanone Openeye Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-2-(3-ethylphenoxy)ethanone CAS Name: 1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-(3-ethylphenoxy)ethanone IUPAC Name: 1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-2-(3-ethylphenoxy)ethanone Traditional Name: 1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-2-(3-ethylphenoxy)ethanone Formula: C18H21BrN2O4S2 MolecularWeight: 473.40434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CCC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

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