3-[[(4-hexoxyphenyl)carbonylamino]carbamoyl]-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 3-[[(4-hexoxyphenyl)carbonylamino]carbamoyl]-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 3-[[(4-hexoxybenzoyl)amino]carbamoyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 3-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 3-[[(4-hexoxybenzoyl)amino]carbamoyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 3-[[(4-hexoxybenzoyl)amino]carbamoyl]-N-propargyl-benzenesulfonamide Formula: C23H27N3O5S MolecularWeight: 457.54258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC#C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC#C

InChI

InChI=1S/C23H27N3O5S/c1-3-5-6-7-16-31-20-13-11-18(12-14-20)22(27)25-26-23(28)19-9-8-10-21(17-19)32(29,30)24-15-4-2/h2,8-14,17,24H,3,5-7,15-16H2,1H3,(H,25,27)(H,26,28)