(3S,4R)-2-methylidene-5-oxidanylidene-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carbonitrile

Systemtic Name: (3S,4R)-2-methylidene-5-oxidanylidene-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carbonitrile Openeye Name: (3S,4R)-2-methylene-5-oxo-4-(thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carbonitrile CAS Name: (3S,4R)-2-methylene-5-oxo-4-(2-thiazolylamino)-4-(trifluoromethyl)-3-pyrrolidinecarbonitrile IUPAC Name: (3S,4R)-2-methylidene-5-oxo-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carbonitrile Traditional Name: (3S,4R)-5-keto-2-methylene-4-(thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carbonitrile Formula: C10H7F3N4OS MolecularWeight: 288.24899

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(C(=O)N1)(C(F)(F)F)NC2=NC=CS2)C#N

Isomeric SMILES

C=C1[C@@H]([C@@](C(=O)N1)(C(F)(F)F)NC2=NC=CS2)C#N

InChI

InChI=1S/C10H7F3N4OS/c1-5-6(4-14)9(7(18)16-5,10(11,12)13)17-8-15-2-3-19-8/h2-3,6H,1H2,(H,15,17)(H,16,18)/t6-,9+/m0/s1