6-bromanyl-3-[[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-bromanyl-3-[[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 6-bromo-3-[[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 6-bromo-3-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-bromo-3-[[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 6-bromo-3-[[4-[(5-chloro-2-thienyl)methyl]piperazino]methyl]-1,3-benzoxazol-2-one Formula: C17H17BrClN3O2S MolecularWeight: 442.75778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)CN3C4=C(C=C(C=C4)Br)OC3=O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)CN3C4=C(C=C(C=C4)Br)OC3=O

InChI

InChI=1S/C17H17BrClN3O2S/c18-12-1-3-14-15(9-12)24-17(23)22(14)11-21-7-5-20(6-8-21)10-13-2-4-16(19)25-13/h1-4,9H,5-8,10-11H2