1-[5-(2-methylpropyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-oxidanyl-piperazine

Systemtic Name: 1-[5-(2-methylpropyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-oxidanyl-piperazine Openeye Name: 3-hydroxy-1-[5-isobutyl-2-(methylsulfanylsulfonylamino)phenyl]piperazine CAS Name: 3-hydroxy-1-[5-(2-methylpropyl)-2-[(methylthio)sulfonylamino]phenyl]piperazine IUPAC Name: 3-hydroxy-1-[5-(2-methylpropyl)-2-(methylsulfanylsulfonylamino)phenyl]piperazine Traditional Name: 3-hydroxy-1-[5-isobutyl-2-[(methylthio)sulfonylamino]phenyl]piperazine Formula: C15H25N3O3S2 MolecularWeight: 359.5073

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)SC)N2CCNC(C2)O

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)SC)N2CCNC(C2)O

InChI

InChI=1S/C15H25N3O3S2/c1-11(2)8-12-4-5-13(17-23(20,21)22-3)14(9-12)18-7-6-16-15(19)10-18/h4-5,9,11,15-17,19H,6-8,10H2,1-3H3