(4S)-2-azanyl-3,5-dicyano-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-6-thiolate

Systemtic Name: (4S)-2-azanyl-3,5-dicyano-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-6-thiolate Openeye Name: (4S)-2-amino-3,5-dicyano-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-6-thiolate CAS Name: (4S)-2-amino-3,5-dicyano-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-6-thiolate IUPAC Name: (4S)-2-amino-3,5-dicyano-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-6-thiolate Traditional Name: (4S)-2-amino-3,5-dicyano-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-6-thiolate Formula: C14H8F3N4S- MolecularWeight: 321.30033

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C(C(=NC(=C2C#N)[S-])N)C#N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)[C@@H]2C(C(=NC(=C2C#N)[S-])N)C#N)C(F)(F)F

InChI

InChI=1S/C14H9F3N4S/c15-14(16,17)10-4-2-1-3-7(10)11-8(5-18)12(20)21-13(22)9(11)6-19/h1-4,8,11,22H,(H2,20,21)/p-1/t8?,11-/m1/s1