4-chloranyl-2-[(8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[(8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]benzenecarbonitrile Openeye Name: 4-chloro-2-[(8-fluorothiochroman-4-yl)amino]benzonitrile CAS Name: 4-chloro-2-[(8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]benzonitrile IUPAC Name: 4-chloro-2-[(8-fluoro-3,4-dihydro-2H-thiochromen-4-yl)amino]benzonitrile Traditional Name: 4-chloro-2-[(8-fluorothiochroman-4-yl)amino]benzonitrile Formula: C16H12ClFN2S MolecularWeight: 318.796283

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC3=C(C=CC(=C3)Cl)C#N)C=CC=C2F

Isomeric SMILES

C1CSC2=C(C1NC3=C(C=CC(=C3)Cl)C#N)C=CC=C2F

InChI

InChI=1S/C16H12ClFN2S/c17-11-5-4-10(9-19)15(8-11)20-14-6-7-21-16-12(14)2-1-3-13(16)18/h1-5,8,14,20H,6-7H2