methyl 4-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C17H13BrN2O3S MolecularWeight: 405.26572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC=C3)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H13BrN2O3S/c1-22-16(21)12-7-5-11(6-8-12)10-24-17-20-19-15(23-17)13-3-2-4-14(18)9-13/h2-9H,10H2,1H3