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

Systemtic Name: 2-[(4-bromanyl-2-morpholin-4-ylcarbothioyl-phenoxy)methyl]benzenecarbonitrile Openeye Name: 2-[[4-bromo-2-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile CAS Name: 2-[[4-bromo-2-[4-morpholinyl(sulfanylidene)methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-bromo-2-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-bromo-2-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile Formula: C19H17BrN2O2S MolecularWeight: 417.31948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O2S/c20-16-5-6-18(24-13-15-4-2-1-3-14(15)12-21)17(11-16)19(25)22-7-9-23-10-8-22/h1-6,11H,7-10,13H2