1-[5-(2-hydroxyphenyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-propan-2-ylsulfonyl-piperazine

Systemtic Name: 1-[5-(2-hydroxyphenyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-propan-2-ylsulfonyl-piperazine Openeye Name: 1-[5-(2-hydroxyphenyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-isopropylsulfonyl-piperazine CAS Name: 1-[5-(2-hydroxyphenyl)-2-[(methylthio)sulfonylamino]phenyl]-3-propan-2-ylsulfonylpiperazine IUPAC Name: 1-[5-(2-hydroxyphenyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-propan-2-ylsulfonylpiperazine Traditional Name: 1-[5-(2-hydroxyphenyl)-2-[(methylthio)sulfonylamino]phenyl]-3-isopropylsulfonyl-piperazine Formula: C20H27N3O5S3 MolecularWeight: 485.64048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)SC

Isomeric SMILES

CC(C)S(=O)(=O)C1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)SC

InChI

InChI=1S/C20H27N3O5S3/c1-14(2)30(25,26)20-13-23(11-10-21-20)18-12-15(16-6-4-5-7-19(16)24)8-9-17(18)22-31(27,28)29-3/h4-9,12,14,20-22,24H,10-11,13H2,1-3H3