2-azanyl-N-[3-(cyanomethoxy)phenyl]-4-methylsulfonyl-butanamide

Systemtic Name: 2-azanyl-N-[3-(cyanomethoxy)phenyl]-4-methylsulfonyl-butanamide Openeye Name: 2-amino-N-[3-(cyanomethoxy)phenyl]-4-methylsulfonyl-butanamide CAS Name: 2-amino-N-[3-(cyanomethoxy)phenyl]-4-methylsulfonylbutanamide IUPAC Name: 2-amino-N-[3-(cyanomethoxy)phenyl]-4-methylsulfonylbutanamide Traditional Name: 2-amino-N-[3-(cyanomethoxy)phenyl]-4-mesyl-butyramide Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC(=CC=C1)OCC#N)N

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)NC1=CC(=CC=C1)OCC#N)N

InChI

InChI=1S/C13H17N3O4S/c1-21(18,19)8-5-12(15)13(17)16-10-3-2-4-11(9-10)20-7-6-14/h2-4,9,12H,5,7-8,15H2,1H3,(H,16,17)