N-[(3S)-4-cyano-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-methyl-butanamide

Systemtic Name: N-[(3S)-4-cyano-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-methyl-butanamide Openeye Name: N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-methyl-butanamide CAS Name: N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-methylbutanamide IUPAC Name: N-[(3S)-4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-methylbutanamide Traditional Name: N-[(3S)-4-cyano-2-keto-5-methyl-3-(trifluoromethyl)-2-pyrrolin-3-yl]-3-methyl-butyramide Formula: C12H14F3N3O2 MolecularWeight: 289.25367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1)(C(F)(F)F)NC(=O)CC(C)C)C#N

Isomeric SMILES

CC1=C([C@](C(=O)N1)(C(F)(F)F)NC(=O)CC(C)C)C#N

InChI

InChI=1S/C12H14F3N3O2/c1-6(2)4-9(19)18-11(12(13,14)15)8(5-16)7(3)17-10(11)20/h6H,4H2,1-3H3,(H,17,20)(H,18,19)/t11-/m0/s1