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

Systemtic Name: 3-methoxy-1-[2-(methylsulfanylsulfonylamino)-5-propan-2-ylsulfonyl-phenyl]piperazine Openeye Name: 1-[5-isopropylsulfonyl-2-(methylsulfanylsulfonylamino)phenyl]-3-methoxy-piperazine CAS Name: 3-methoxy-1-[2-[(methylthio)sulfonylamino]-5-propan-2-ylsulfonylphenyl]piperazine IUPAC Name: 3-methoxy-1-[2-(methylsulfanylsulfonylamino)-5-propan-2-ylsulfonylphenyl]piperazine Traditional Name: 1-[5-isopropylsulfonyl-2-[(methylthio)sulfonylamino]phenyl]-3-methoxy-piperazine Formula: C15H25N3O5S3 MolecularWeight: 423.5711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O5S3/c1-11(2)25(19,20)12-5-6-13(17-26(21,22)24-4)14(9-12)18-8-7-16-15(10-18)23-3/h5-6,9,11,15-17H,7-8,10H2,1-4H3