N-(3-cyclopropylprop-2-ynyl)-N-[(4,5-dimethylcyclohexa-1,4-dien-1-yl)methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-(3-cyclopropylprop-2-ynyl)-N-[(4,5-dimethylcyclohexa-1,4-dien-1-yl)methyl]-4-methyl-benzenesulfonamide Openeye Name: N-(3-cyclopropylprop-2-ynyl)-N-[(4,5-dimethylcyclohexa-1,4-dien-1-yl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-(3-cyclopropylprop-2-ynyl)-N-[(4,5-dimethyl-1-cyclohexa-1,4-dienyl)methyl]-4-methylbenzenesulfonamide IUPAC Name: N-(3-cyclopropylprop-2-ynyl)-N-[(4,5-dimethylcyclohexa-1,4-dien-1-yl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-(3-cyclopropylprop-2-ynyl)-N-[(4,5-dimethylcyclohexa-1,4-dien-1-yl)methyl]-4-methyl-benzenesulfonamide Formula: C22H27NO2S MolecularWeight: 369.52028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=CC1)CN(CC#CC2CC2)S(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC1=C(CC(=CC1)CN(CC#CC2CC2)S(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H27NO2S/c1-17-6-12-22(13-7-17)26(24,25)23(14-4-5-20-10-11-20)16-21-9-8-18(2)19(3)15-21/h6-7,9,12-13,20H,8,10-11,14-16H2,1-3H3