4-methyl-N-[(3S)-2-methylhexa-4,5-dien-3-yl]-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 4-methyl-N-[(3S)-2-methylhexa-4,5-dien-3-yl]-N-prop-2-ynyl-benzenesulfonamide Openeye Name: N-[(1S)-1-isopropylbuta-2,3-dienyl]-4-methyl-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-methyl-N-[(3S)-2-methylhexa-4,5-dien-3-yl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-methyl-N-[(3S)-2-methylhexa-4,5-dien-3-yl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: N-[(1S)-1-isopropylbuta-2,3-dienyl]-4-methyl-N-propargyl-benzenesulfonamide Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO2S/c1-6-8-17(14(3)4)18(13-7-2)21(19,20)16-11-9-15(5)10-12-16/h2,8-12,14,17H,1,13H2,3-5H3/t17-/m1/s1