4-tert-butyl-N-[7-(4-methylpiperazin-1-yl)-2,3-dihydro-1-benzofuran-5-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[7-(4-methylpiperazin-1-yl)-2,3-dihydro-1-benzofuran-5-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[7-(4-methylpiperazin-1-yl)-2,3-dihydrobenzofuran-5-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[7-(4-methyl-1-piperazinyl)-2,3-dihydrobenzofuran-5-yl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[7-(4-methylpiperazin-1-yl)-2,3-dihydro-1-benzofuran-5-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[7-(4-methylpiperazino)coumaran-5-yl]benzenesulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C3C(=C2)CCO3)N4CCN(CC4)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C3C(=C2)CCO3)N4CCN(CC4)C

InChI

InChI=1S/C23H31N3O3S/c1-23(2,3)18-5-7-20(8-6-18)30(27,28)24-19-15-17-9-14-29-22(17)21(16-19)26-12-10-25(4)11-13-26/h5-8,15-16,24H,9-14H2,1-4H3