N-(4-methylphenyl)sulfonyl-N'-[2-(phenylsulfonylamino)ethyl]-2-pyrrolidin-1-yl-ethanimidamide

Systemtic Name: N-(4-methylphenyl)sulfonyl-N'-[2-(phenylsulfonylamino)ethyl]-2-pyrrolidin-1-yl-ethanimidamide Openeye Name: N'-[2-(benzenesulfonamido)ethyl]-N-(p-tolylsulfonyl)-2-pyrrolidin-1-yl-acetamidine CAS Name: N'-[2-(benzenesulfonamido)ethyl]-N-(4-methylphenyl)sulfonyl-2-(1-pyrrolidinyl)ethanimidamide IUPAC Name: N'-[2-(benzenesulfonamido)ethyl]-N-(4-methylphenyl)sulfonyl-2-pyrrolidin-1-ylethanimidamide Traditional Name: N'-[2-(benzenesulfonamido)ethyl]-2-pyrrolidino-N-tosyl-acetamidine Formula: C21H28N4O4S2 MolecularWeight: 464.60142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCNS(=O)(=O)C2=CC=CC=C2)CN3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCNS(=O)(=O)C2=CC=CC=C2)CN3CCCC3

InChI

InChI=1S/C21H28N4O4S2/c1-18-9-11-20(12-10-18)31(28,29)24-21(17-25-15-5-6-16-25)22-13-14-23-30(26,27)19-7-3-2-4-8-19/h2-4,7-12,23H,5-6,13-17H2,1H3,(H,22,24)