2-azanyl-N-(5-cyano-3-fluoranyl-2-methyl-phenyl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-azanyl-N-(5-cyano-3-fluoranyl-2-methyl-phenyl)-4-methylsulfonyl-butanamide Openeye Name: 2-amino-N-(5-cyano-3-fluoro-2-methyl-phenyl)-4-methylsulfonyl-butanamide CAS Name: 2-amino-N-(5-cyano-3-fluoro-2-methylphenyl)-4-methylsulfonylbutanamide IUPAC Name: 2-amino-N-(5-cyano-3-fluoro-2-methylphenyl)-4-methylsulfonylbutanamide Traditional Name: 2-amino-N-(5-cyano-3-fluoro-2-methyl-phenyl)-4-mesyl-butyramide Formula: C13H16FN3O3S MolecularWeight: 313.347843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NC(=O)C(CCS(=O)(=O)C)N

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NC(=O)C(CCS(=O)(=O)C)N

InChI

InChI=1S/C13H16FN3O3S/c1-8-10(14)5-9(7-15)6-12(8)17-13(18)11(16)3-4-21(2,19)20/h5-6,11H,3-4,16H2,1-2H3,(H,17,18)