1-[[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-chloranyl-phenyl]methyl]azetidine

Systemtic Name: 1-[[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-chloranyl-phenyl]methyl]azetidine Openeye Name: 1-[[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-chloro-phenyl]methyl]azetidine CAS Name: 1-[[2-[(5-bromo-2-methoxyphenyl)methylthio]-3-chlorophenyl]methyl]azetidine IUPAC Name: 1-[[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-chlorophenyl]methyl]azetidine Traditional Name: 1-[2-[(5-bromo-2-methoxy-benzyl)thio]-3-chloro-benzyl]azetidine Formula: C18H19BrClNOS MolecularWeight: 412.77156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC=C2Cl)CN3CCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC=C2Cl)CN3CCC3

InChI

InChI=1S/C18H19BrClNOS/c1-22-17-7-6-15(19)10-14(17)12-23-18-13(4-2-5-16(18)20)11-21-8-3-9-21/h2,4-7,10H,3,8-9,11-12H2,1H3