2-[[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazole Openeye Name: 2-[[4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazole CAS Name: 2-[[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazole Traditional Name: 2-[[4-[(5-bromo-2-thienyl)methyl]piperazino]methyl]-1,3-benzoxazole Formula: C17H18BrN3OS MolecularWeight: 392.31332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Br)CC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Br)CC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H18BrN3OS/c18-16-6-5-13(23-16)11-20-7-9-21(10-8-20)12-17-19-14-3-1-2-4-15(14)22-17/h1-6H,7-12H2