4-chloranyl-2-[3-(dimethylaminomethyl)-2-ethylsulfinyl-phenoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[3-(dimethylaminomethyl)-2-ethylsulfinyl-phenoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-ethylsulfinyl-phenoxy]benzonitrile CAS Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-ethylsulfinylphenoxy]benzonitrile IUPAC Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-ethylsulfinylphenoxy]benzonitrile Traditional Name: 4-chloro-2-[3-(dimethylaminomethyl)-2-ethylsulfinyl-phenoxy]benzonitrile Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=C(C=CC=C1OC2=C(C=CC(=C2)Cl)C#N)CN(C)C

Isomeric SMILES

CCS(=O)C1=C(C=CC=C1OC2=C(C=CC(=C2)Cl)C#N)CN(C)C

InChI

InChI=1S/C18H19ClN2O2S/c1-4-24(22)18-14(12-21(2)3)6-5-7-16(18)23-17-10-15(19)9-8-13(17)11-20/h5-10H,4,12H2,1-3H3