N-(4-cyano-4-deuterio-butyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(4-cyano-4-deuterio-butyl)-4-methyl-benzenesulfonamide Openeye Name: N-(4-cyano-4-deuterio-butyl)-4-methyl-benzenesulfonamide CAS Name: N-(4-cyano-4-deuteriobutyl)-4-methylbenzenesulfonamide IUPAC Name: N-(4-cyano-4-deuteriobutyl)-4-methylbenzenesulfonamide Traditional Name: N-(4-cyano-4-deuterio-butyl)-4-methyl-benzenesulfonamide Formula: C12H16N2O2S MolecularWeight: 253.338802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCC#N

Isomeric SMILES

[2H]C(CCCNS(=O)(=O)C1=CC=C(C=C1)C)C#N

InChI

InChI=1S/C12H16N2O2S/c1-11-5-7-12(8-6-11)17(15,16)14-10-4-2-3-9-13/h5-8,14H,2-4,10H2,1H3/i3D