1-[5-methyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-methylsulfanyl-piperazine

Systemtic Name: 1-[5-methyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-methylsulfanyl-piperazine Openeye Name: 1-[2-(isopropylsulfonylsulfonylamino)-5-methyl-phenyl]-3-methylsulfanyl-piperazine CAS Name: 1-[5-methyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-(methylthio)piperazine IUPAC Name: 1-[5-methyl-2-(propan-2-ylsulfonylsulfonylamino)phenyl]-3-methylsulfanylpiperazine Traditional Name: 1-[2-(isopropylsulfonylsulfonylamino)-5-methyl-phenyl]-3-(methylthio)piperazine Formula: C15H25N3O4S3 MolecularWeight: 407.5717

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O4S3/c1-11(2)24(19,20)25(21,22)17-13-6-5-12(3)9-14(13)18-8-7-16-15(10-18)23-4/h5-6,9,11,15-17H,7-8,10H2,1-4H3