1-[5-ethyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine

Systemtic Name: 1-[5-ethyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine Openeye Name: 1-[5-ethyl-2-(isopropylsulfonylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine CAS Name: 1-[5-ethyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine IUPAC Name: 1-[5-ethyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine Traditional Name: 1-[5-ethyl-2-(isopropylsulfonylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine Formula: C21H29N3O5S2 MolecularWeight: 467.60206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)C3=CC=CC=C3O

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)C3=CC=CC=C3O

InChI

InChI=1S/C21H29N3O5S2/c1-4-16-9-10-18(23-31(28,29)30(26,27)15(2)3)20(13-16)24-12-11-22-19(14-24)17-7-5-6-8-21(17)25/h5-10,13,15,19,22-23,25H,4,11-12,14H2,1-3H3