N,N'-(Iminoditrimethylene)di-p-toluenesulfonamide

4-methyl-N-[3-[3-[(4-methylphenyl)sulfonylamino]propylamino]propyl]benzenesulfonamide;hydrochloride

CAS: 13380-01-3

Molecular Formula	`C20H30ClN3O4S2`
Molecular Weight	476.1 g/mol
Topological Polar Surface Area	121.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	7
Rotatable Bonds	12
Exact Mass	475.13663
Heavy Atoms	30
Complexity	597.0

Chemical Identifiers

CAS Number	13380-01-3
SMILES	`CC1=CC=C(C=C1)S(=O)(=O)NCCCNCCCNS(=O)(=O)C2=CC=C(C=C2)C.Cl`
InChIKey	`QMDIBHGMMFHRMW-UHFFFAOYSA-N`

📖 Product Overview

N,N'-(Iminoditrimethylene)di-p-toluenesulfonamide (CAS: 13380-01-3) is a chemical compound with molecular formula C20H30ClN3O4S2 and molecular weight 476.1 g/mol. Its IUPAC systematic name is 4-methyl-N-[3-[3-[(4-methylphenyl)sulfonylamino]propylamino]propyl]benzenesulfonamide;hydrochloride. Topological Polar Surface Area 121.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 7 Rotatable Bonds 12 Exact Mass 475.13663 Heavy Atoms 30 Complexity 597.0 InChI Key: QMDIBHGMMFHRMW-UHFFFAOYSA-N. SMILES: CC1=CC=C(C=C1)S(=O)(=O)NCCCNCCCNS(=O)(=O)C2=CC=C(C=C2)C.Cl.

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