3-[[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 3-[[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 3-[[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 3-[[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]methyl]-1,3-benzoxazol-2-one Formula: C18H17BrClN3O4S MolecularWeight: 486.76728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CN(CCN1CN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C18H17BrClN3O4S/c19-13-5-6-17(14(20)11-13)28(25,26)22-9-7-21(8-10-22)12-23-15-3-1-2-4-16(15)27-18(23)24/h1-6,11H,7-10,12H2