S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-bromanylbenzenecarbothioate

Systemtic Name: S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-bromanylbenzenecarbothioate Openeye Name: S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-bromobenzenecarbothioate CAS Name: 4-bromobenzenecarbothioic acid S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] ester IUPAC Name: S-[5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl] 4-bromobenzenecarbothioate Traditional Name: 4-bromothiobenzoic acid S-[5-(4-chlorobenzyl)-1,3,4-oxadiazol-2-yl] ester Formula: C16H10BrClN2O2S MolecularWeight: 409.6848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NN=C(O2)SC(=O)C3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=NN=C(O2)SC(=O)C3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C16H10BrClN2O2S/c17-12-5-3-11(4-6-12)15(21)23-16-20-19-14(22-16)9-10-1-7-13(18)8-2-10/h1-8H,9H2