3-(3,4-dihydro-2H-thiochromen-4-ylamino)-5-fluoranyl-4-methyl-benzenecarbonitrile

Systemtic Name: 3-(3,4-dihydro-2H-thiochromen-4-ylamino)-5-fluoranyl-4-methyl-benzenecarbonitrile Openeye Name: 3-fluoro-4-methyl-5-(thiochroman-4-ylamino)benzonitrile CAS Name: 3-(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)-5-fluoro-4-methylbenzonitrile IUPAC Name: 3-(3,4-dihydro-2H-thiochromen-4-ylamino)-5-fluoro-4-methylbenzonitrile Traditional Name: 3-fluoro-4-methyl-5-(thiochroman-4-ylamino)benzonitrile Formula: C17H15FN2S MolecularWeight: 298.377803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NC2CCSC3=CC=CC=C23

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NC2CCSC3=CC=CC=C23

InChI

InChI=1S/C17H15FN2S/c1-11-14(18)8-12(10-19)9-16(11)20-15-6-7-21-17-5-3-2-4-13(15)17/h2-5,8-9,15,20H,6-7H2,1H3