5-cyano-6-[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 5-cyano-6-[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 5-cyano-6-[(1S)-1-[(4-fluorophenyl)carbamoyl]propyl]sulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide CAS Name: 5-cyano-6-[[(2S)-1-(4-fluoroanilino)-1-oxobutan-2-yl]thio]-2-methyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 5-cyano-6-[(2S)-1-(4-fluoroanilino)-1-oxobutan-2-yl]sulfanyl-2-methyl-N-phenylpyridine-3-carboxamide Traditional Name: 5-cyano-6-[[(1S)-1-[(4-fluorophenyl)carbamoyl]propyl]thio]-2-methyl-N-phenyl-nicotinamide Formula: C24H21FN4O2S MolecularWeight: 448.512543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC(=C(C=C2C#N)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=C(C=C1)F)SC2=NC(=C(C=C2C#N)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C24H21FN4O2S/c1-3-21(23(31)29-19-11-9-17(25)10-12-19)32-24-16(14-26)13-20(15(2)27-24)22(30)28-18-7-5-4-6-8-18/h4-13,21H,3H2,1-2H3,(H,28,30)(H,29,31)/t21-/m0/s1