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

Systemtic Name: [4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-(3-chloranyl-4-oxidanyl-phenyl)methanone Openeye Name: [4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]-(3-chloro-4-hydroxy-phenyl)methanone CAS Name: [4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]-(3-chloro-4-hydroxyphenyl)methanone IUPAC Name: [4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]-(3-chloro-4-hydroxyphenyl)methanone Traditional Name: [4-[(5-bromo-2-thienyl)methyl]piperazino]-(3-chloro-4-hydroxy-phenyl)methanone Formula: C16H16BrClN2O2S MolecularWeight: 415.73244

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Br)C(=O)C3=CC(=C(C=C3)O)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Br)C(=O)C3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C16H16BrClN2O2S/c17-15-4-2-12(23-15)10-19-5-7-20(8-6-19)16(22)11-1-3-14(21)13(18)9-11/h1-4,9,21H,5-8,10H2