4-(5-bromanylthiophen-2-yl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(5-bromanylthiophen-2-yl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]butan-1-one Openeye Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-4-(5-bromo-2-thienyl)butan-1-one CAS Name: 1-[4-(4-acetylphenyl)-1-piperazinyl]-4-(5-bromo-2-thiophenyl)-1-butanone IUPAC Name: 1-[4-(4-acetylphenyl)piperazin-1-yl]-4-(5-bromothiophen-2-yl)butan-1-one Traditional Name: 1-[4-(4-acetylphenyl)piperazino]-4-(5-bromo-2-thienyl)butan-1-one Formula: C20H23BrN2O2S MolecularWeight: 435.37782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCC3=CC=C(S3)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCC3=CC=C(S3)Br

InChI

InChI=1S/C20H23BrN2O2S/c1-15(24)16-5-7-17(8-6-16)22-11-13-23(14-12-22)20(25)4-2-3-18-9-10-19(21)26-18/h5-10H,2-4,11-14H2,1H3