1-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone

Systemtic Name: 1-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone Openeye Name: 1-[4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone CAS Name: 1-[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]-2-(3-methylphenoxy)ethanone IUPAC Name: 1-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone Traditional Name: 1-[4-[(5-bromo-2-thienyl)methyl]piperazino]-2-(3-methylphenoxy)ethanone Formula: C18H21BrN2O2S MolecularWeight: 409.34054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)CC3=CC=C(S3)Br

InChI

InChI=1S/C18H21BrN2O2S/c1-14-3-2-4-15(11-14)23-13-18(22)21-9-7-20(8-10-21)12-16-5-6-17(19)24-16/h2-6,11H,7-10,12-13H2,1H3