N-[(Z,3E)-2-tert-butyl-3-(ethoxymethylidene)-4,4-dimethyl-pent-1-enyl]sulfanyl-4-methyl-benzenesulfonamide

Systemtic Name: N-[(Z,3E)-2-tert-butyl-3-(ethoxymethylidene)-4,4-dimethyl-pent-1-enyl]sulfanyl-4-methyl-benzenesulfonamide Openeye Name: N-[(Z,3E)-2-tert-butyl-3-(ethoxymethylene)-4,4-dimethyl-pent-1-enyl]sulfanyl-4-methyl-benzenesulfonamide CAS Name: N-[[(Z,3E)-2-tert-butyl-3-(ethoxymethylidene)-4,4-dimethylpent-1-enyl]thio]-4-methylbenzenesulfonamide IUPAC Name: N-[(Z,3E)-2-tert-butyl-3-(ethoxymethylidene)-4,4-dimethylpent-1-enyl]sulfanyl-4-methylbenzenesulfonamide Traditional Name: N-[[(1Z,3E)-2,3-ditert-butyl-4-ethoxy-buta-1,3-dienyl]thio]-4-methyl-benzenesulfonamide Formula: C21H33NO3S2 MolecularWeight: 411.62162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C(C(=CSNS(=O)(=O)C1=CC=C(C=C1)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCO/C=C(/C(=C\SNS(=O)(=O)C1=CC=C(C=C1)C)/C(C)(C)C)\C(C)(C)C

InChI

InChI=1S/C21H33NO3S2/c1-9-25-14-18(20(3,4)5)19(21(6,7)8)15-26-22-27(23,24)17-12-10-16(2)11-13-17/h10-15,22H,9H2,1-8H3/b18-14-,19-15+