2-[[2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2,6-bis(bromanyl)-4-morpholin-4-ylcarbothioyl-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2,6-dibromo-4-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile CAS Name: 2-[[2,6-dibromo-4-[4-morpholinyl(sulfanylidene)methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[2,6-dibromo-4-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile Traditional Name: 2-[[2,6-dibromo-4-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile Formula: C19H16Br2N2O2S MolecularWeight: 496.21554

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3C#N)Br

Isomeric SMILES

C1COCCN1C(=S)C2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3C#N)Br

InChI

InChI=1S/C19H16Br2N2O2S/c20-16-9-15(19(26)23-5-7-24-8-6-23)10-17(21)18(16)25-12-14-4-2-1-3-13(14)11-22/h1-4,9-10H,5-8,12H2