1-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-2-[methyl(2-phenoxyethyl)amino]ethanone

Systemtic Name: 1-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-2-[methyl(2-phenoxyethyl)amino]ethanone Openeye Name: 1-[4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]-2-[methyl(2-phenoxyethyl)amino]ethanone CAS Name: 1-[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]-2-[methyl(2-phenoxyethyl)amino]ethanone IUPAC Name: 1-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]-2-[methyl(2-phenoxyethyl)amino]ethanone Traditional Name: 1-[4-[(5-bromo-2-thienyl)methyl]piperazino]-2-[methyl(2-phenoxyethyl)amino]ethanone Formula: C20H26BrN3O2S MolecularWeight: 452.40834

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC=C1)CC(=O)N2CCN(CC2)CC3=CC=C(S3)Br

Isomeric SMILES

CN(CCOC1=CC=CC=C1)CC(=O)N2CCN(CC2)CC3=CC=C(S3)Br

InChI

InChI=1S/C20H26BrN3O2S/c1-22(13-14-26-17-5-3-2-4-6-17)16-20(25)24-11-9-23(10-12-24)15-18-7-8-19(21)27-18/h2-8H,9-16H2,1H3