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

Systemtic Name: 3-[[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]methyl]-5-(furan-2-yl)-1,2-oxazole Openeye Name: 3-[[4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]methyl]-5-(2-furyl)isoxazole CAS Name: 3-[[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]methyl]-5-(2-furanyl)isoxazole IUPAC Name: 3-[[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]methyl]-5-(furan-2-yl)-1,2-oxazole Traditional Name: 3-[[4-[(5-bromo-2-thienyl)methyl]piperazino]methyl]-5-(2-furyl)isoxazole Formula: C17H18BrN3O2S MolecularWeight: 408.31272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Br)CC3=NOC(=C3)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Br)CC3=NOC(=C3)C4=CC=CO4

InChI

InChI=1S/C17H18BrN3O2S/c18-17-4-3-14(24-17)12-21-7-5-20(6-8-21)11-13-10-16(23-19-13)15-2-1-9-22-15/h1-4,9-10H,5-8,11-12H2