N-[(2S,3R)-3-ethynyl-5-methyl-1-phenyl-hex-4-en-2-yl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[(2S,3R)-3-ethynyl-5-methyl-1-phenyl-hex-4-en-2-yl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[(1S,2R)-1-benzyl-2-ethynyl-4-methyl-pent-3-enyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[(2S,3R)-3-ethynyl-5-methyl-1-phenylhex-4-en-2-yl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[(2S,3R)-3-ethynyl-5-methyl-1-phenylhex-4-en-2-yl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[(1S,2R)-1-benzyl-2-ethynyl-4-methyl-pent-3-enyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C24H29NO2S MolecularWeight: 395.55756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(CC2=CC=CC=C2)C(C=C(C)C)C#C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)[C@H](C=C(C)C)C#C)C

InChI

InChI=1S/C24H29NO2S/c1-7-22(13-17(2)3)23(16-21-11-9-8-10-12-21)25-28(26,27)24-19(5)14-18(4)15-20(24)6/h1,8-15,22-23,25H,16H2,2-6H3/t22-,23-/m0/s1