N-but-3-ynyl-N-[1-(3,4-dimethoxyphenyl)but-3-yn-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-but-3-ynyl-N-[1-(3,4-dimethoxyphenyl)but-3-yn-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-but-3-ynyl-N-[1-[(3,4-dimethoxyphenyl)methyl]prop-2-ynyl]-4-methyl-benzenesulfonamide CAS Name: N-but-3-ynyl-N-[1-(3,4-dimethoxyphenyl)but-3-yn-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-but-3-ynyl-N-[1-(3,4-dimethoxyphenyl)but-3-yn-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-but-3-ynyl-4-methyl-N-(1-veratrylprop-2-ynyl)benzenesulfonamide Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC#C)C(CC2=CC(=C(C=C2)OC)OC)C#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC#C)C(CC2=CC(=C(C=C2)OC)OC)C#C

InChI

InChI=1S/C23H25NO4S/c1-6-8-15-24(29(25,26)21-12-9-18(3)10-13-21)20(7-2)16-19-11-14-22(27-4)23(17-19)28-5/h1-2,9-14,17,20H,8,15-16H2,3-5H3