N-[(1R,2S)-1-cyano-2-methyl-butyl]-4-methyl-benzenesulfinamide

Systemtic Name: N-[(1R,2S)-1-cyano-2-methyl-butyl]-4-methyl-benzenesulfinamide Openeye Name: N-[(1R,2S)-1-cyano-2-methyl-butyl]-4-methyl-benzenesulfinamide CAS Name: N-[(1R,2S)-1-cyano-2-methylbutyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(1R,2S)-1-cyano-2-methylbutyl]-4-methylbenzenesulfinamide Traditional Name: N-[(1R,2S)-1-cyano-2-methyl-butyl]-4-methyl-benzenesulfinamide Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C#N)NS(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CC[C@H](C)[C@H](C#N)N[S@](=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C13H18N2OS/c1-4-11(3)13(9-14)15-17(16)12-7-5-10(2)6-8-12/h5-8,11,13,15H,4H2,1-3H3/t11-,13-,17+/m0/s1