N-[(1S,3R)-1-cyano-3-methyl-4-phenylmethoxy-butyl]-4-methyl-benzenesulfinamide

Systemtic Name: N-[(1S,3R)-1-cyano-3-methyl-4-phenylmethoxy-butyl]-4-methyl-benzenesulfinamide Openeye Name: N-[(1S,3R)-4-benzyloxy-1-cyano-3-methyl-butyl]-4-methyl-benzenesulfinamide CAS Name: N-[(1S,3R)-1-cyano-3-methyl-4-phenylmethoxybutyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(1S,3R)-1-cyano-3-methyl-4-phenylmethoxybutyl]-4-methylbenzenesulfinamide Traditional Name: N-[(1S,3R)-4-benzoxy-1-cyano-3-methyl-butyl]-4-methyl-benzenesulfinamide Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(CC(C)COCC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)N[C@@H](C[C@@H](C)COCC2=CC=CC=C2)C#N

InChI

InChI=1S/C20H24N2O2S/c1-16-8-10-20(11-9-16)25(23)22-19(13-21)12-17(2)14-24-15-18-6-4-3-5-7-18/h3-11,17,19,22H,12,14-15H2,1-2H3/t17-,19+,25+/m1/s1