N-tert-butyl-5-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-2-methoxy-benzenesulfonamide

Systemtic Name: N-tert-butyl-5-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-2-methoxy-benzenesulfonamide Openeye Name: N-tert-butyl-5-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-2-methoxy-benzenesulfonamide CAS Name: N-tert-butyl-5-[[4-(2-hydroxyphenyl)-1-piperazinyl]-oxomethyl]-2-methoxybenzenesulfonamide IUPAC Name: N-tert-butyl-5-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-2-methoxybenzenesulfonamide Traditional Name: N-tert-butyl-5-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-2-methoxy-benzenesulfonamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3O)OC

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3O)OC

InChI

InChI=1S/C22H29N3O5S/c1-22(2,3)23-31(28,29)20-15-16(9-10-19(20)30-4)21(27)25-13-11-24(12-14-25)17-7-5-6-8-18(17)26/h5-10,15,23,26H,11-14H2,1-4H3