2-[(2-chloranyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenoxy)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-chloranyl-6-methoxy-4-morpholin-4-ylcarbothioyl-phenoxy)methyl]benzenecarbonitrile Openeye Name: 2-[[2-chloro-6-methoxy-4-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile CAS Name: 2-[[2-chloro-6-methoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-chloro-6-methoxy-4-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile Traditional Name: 2-[[2-chloro-6-methoxy-4-(morpholine-4-carbothioyl)phenoxy]methyl]benzonitrile Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OCC3=CC=CC=C3C#N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Cl)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H19ClN2O3S/c1-24-18-11-16(20(27)23-6-8-25-9-7-23)10-17(21)19(18)26-13-15-5-3-2-4-14(15)12-22/h2-5,10-11H,6-9,13H2,1H3