ethyl 2-[(5E)-5-(5-bromanyl-3-phenyl-indol-2-ylidene)-2-sulfanylidene-1,3,4-oxadiazolidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[(5E)-5-(5-bromanyl-3-phenyl-indol-2-ylidene)-2-sulfanylidene-1,3,4-oxadiazolidin-3-yl]ethanoate Openeye Name: ethyl 2-[(5E)-5-(5-bromo-3-phenyl-indol-2-ylidene)-2-thioxo-1,3,4-oxadiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-(5-bromo-3-phenyl-2-indolylidene)-2-sulfanylidene-1,3,4-oxadiazolidin-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5E)-5-(5-bromo-3-phenylindol-2-ylidene)-2-sulfanylidene-1,3,4-oxadiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-5-(5-bromo-3-phenyl-indol-2-ylidene)-2-thioxo-1,3,4-oxadiazolidin-3-yl]acetic acid ethyl ester Formula: C20H16BrN3O3S MolecularWeight: 458.32834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=S)OC(=C2C(=C3C=C(C=CC3=N2)Br)C4=CC=CC=C4)N1

Isomeric SMILES

CCOC(=O)CN1C(=S)O/C(=C/2\C(=C3C=C(C=CC3=N2)Br)C4=CC=CC=C4)/N1

InChI

InChI=1S/C20H16BrN3O3S/c1-2-26-16(25)11-24-20(28)27-19(23-24)18-17(12-6-4-3-5-7-12)14-10-13(21)8-9-15(14)22-18/h3-10,23H,2,11H2,1H3/b19-18+