1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid 1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C14H9Br2N3O3S MolecularWeight: 459.11256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C14H9Br2N3O3S/c1-7(21-14(20)10-5-9(15)11(16)23-10)13-18-12(19-22-13)8-3-2-4-17-6-8/h2-7H,1H3