5-(4-bromanyl-3-methoxy-thiophen-2-yl)-3-(cyclohexylsulfanylmethyl)-1,3,4-oxadiazol-2-one

Systemtic Name: 5-(4-bromanyl-3-methoxy-thiophen-2-yl)-3-(cyclohexylsulfanylmethyl)-1,3,4-oxadiazol-2-one Openeye Name: 5-(4-bromo-3-methoxy-2-thienyl)-3-(cyclohexylsulfanylmethyl)-1,3,4-oxadiazol-2-one CAS Name: 5-(4-bromo-3-methoxy-2-thiophenyl)-3-[(cyclohexylthio)methyl]-1,3,4-oxadiazol-2-one IUPAC Name: 5-(4-bromo-3-methoxythiophen-2-yl)-3-(cyclohexylsulfanylmethyl)-1,3,4-oxadiazol-2-one Traditional Name: 5-(4-bromo-3-methoxy-2-thienyl)-3-[(cyclohexylthio)methyl]-1,3,4-oxadiazol-2-one Formula: C14H17BrN2O3S2 MolecularWeight: 405.33038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC=C1Br)C2=NN(C(=O)O2)CSC3CCCCC3

Isomeric SMILES

COC1=C(SC=C1Br)C2=NN(C(=O)O2)CSC3CCCCC3

InChI

InChI=1S/C14H17BrN2O3S2/c1-19-11-10(15)7-21-12(11)13-16-17(14(18)20-13)8-22-9-5-3-2-4-6-9/h7,9H,2-6,8H2,1H3