4-chloranyl-5-fluoranyl-2-[3-(2-hydroxyethylamino)-1-thiophen-3-yl-propoxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-5-fluoranyl-2-[3-(2-hydroxyethylamino)-1-thiophen-3-yl-propoxy]benzenecarbonitrile Openeye Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-(3-thienyl)propoxy]benzonitrile CAS Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-(3-thiophenyl)propoxy]benzonitrile IUPAC Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-thiophen-3-ylpropoxy]benzonitrile Traditional Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-(3-thienyl)propoxy]benzonitrile Formula: C16H16ClFN2O2S MolecularWeight: 354.826843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C(CCNCCO)OC2=CC(=C(C=C2C#N)F)Cl

Isomeric SMILES

C1=CSC=C1C(CCNCCO)OC2=CC(=C(C=C2C#N)F)Cl

InChI

InChI=1S/C16H16ClFN2O2S/c17-13-8-16(12(9-19)7-14(13)18)22-15(1-3-20-4-5-21)11-2-6-23-10-11/h2,6-8,10,15,20-21H,1,3-5H2