N-[(E,2S)-3-ethynylpent-3-en-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(E,2S)-3-ethynylpent-3-en-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(E,1S)-2-ethynyl-1-methyl-but-2-enyl]-4-methyl-benzenesulfonamide CAS Name: N-[(E,2S)-3-ethynylpent-3-en-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(E,2S)-3-ethynylpent-3-en-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(E,1S)-2-ethynyl-1-methyl-but-2-enyl]-4-methyl-benzenesulfonamide Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C(\C#C)/[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H17NO2S/c1-5-13(6-2)12(4)15-18(16,17)14-9-7-11(3)8-10-14/h1,6-10,12,15H,2-4H3/b13-6+/t12-/m0/s1