5-(4-bromanyl-3-methoxy-thiophen-2-yl)-3-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-one

Systemtic Name: 5-(4-bromanyl-3-methoxy-thiophen-2-yl)-3-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-one Openeye Name: 5-(4-bromo-3-methoxy-2-thienyl)-3-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-one CAS Name: 5-(4-bromo-3-methoxy-2-thiophenyl)-3-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-one IUPAC Name: 5-(4-bromo-3-methoxythiophen-2-yl)-3-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-one Traditional Name: 5-(4-bromo-3-methoxy-2-thienyl)-3-(4-mesylbenzyl)-1,3,4-oxadiazol-2-one Formula: C15H13BrN2O5S2 MolecularWeight: 445.30812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC=C1Br)C2=NN(C(=O)O2)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC1=C(SC=C1Br)C2=NN(C(=O)O2)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C15H13BrN2O5S2/c1-22-12-11(16)8-24-13(12)14-17-18(15(19)23-14)7-9-3-5-10(6-4-9)25(2,20)21/h3-6,8H,7H2,1-2H3