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

Systemtic Name: 1-[2-(methylsulfanylsulfonylamino)-5-phenyl-phenyl]-3-propan-2-ylsulfonyl-piperazine Openeye Name: 3-isopropylsulfonyl-1-[2-(methylsulfanylsulfonylamino)-5-phenyl-phenyl]piperazine CAS Name: 1-[2-[(methylthio)sulfonylamino]-5-phenylphenyl]-3-propan-2-ylsulfonylpiperazine IUPAC Name: 1-[2-(methylsulfanylsulfonylamino)-5-phenylphenyl]-3-propan-2-ylsulfonylpiperazine Traditional Name: 3-isopropylsulfonyl-1-[2-[(methylthio)sulfonylamino]-5-phenyl-phenyl]piperazine Formula: C20H27N3O4S3 MolecularWeight: 469.64108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O4S3/c1-15(2)29(24,25)20-14-23(12-11-21-20)19-13-17(16-7-5-4-6-8-16)9-10-18(19)22-30(26,27)28-3/h4-10,13,15,20-22H,11-12,14H2,1-3H3