[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: [4-[(5-bromo-2-thienyl)methyl]piperazino]-(3-fluoro-4-methoxy-phenyl)methanone Formula: C17H18BrFN2O2S MolecularWeight: 413.304423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(S3)Br)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(S3)Br)F

InChI

InChI=1S/C17H18BrFN2O2S/c1-23-15-4-2-12(10-14(15)19)17(22)21-8-6-20(7-9-21)11-13-3-5-16(18)24-13/h2-5,10H,6-9,11H2,1H3