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

Systemtic Name: 1-[5-ethyl-2-(methylsulfanylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine Openeye Name: 1-[5-ethyl-2-(methylsulfanylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine CAS Name: 1-[5-ethyl-2-[(methylthio)sulfonylamino]phenyl]-3-(2-hydroxyphenyl)piperazine IUPAC Name: 1-[5-ethyl-2-(methylsulfanylsulfonylamino)phenyl]-3-(2-hydroxyphenyl)piperazine Traditional Name: 1-[5-ethyl-2-[(methylthio)sulfonylamino]phenyl]-3-(2-hydroxyphenyl)piperazine Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O3S2/c1-3-14-8-9-16(21-27(24,25)26-2)18(12-14)22-11-10-20-17(13-22)15-6-4-5-7-19(15)23/h4-9,12,17,20-21,23H,3,10-11,13H2,1-2H3