Compound C19H22N2O5S

dimethyl-[2-(N-methyl-4-phenylsulfanylanilino)-2-oxoethyl]azanium;2-hydroxy-2-oxoacetate

CAS: 77711-41-2

Molecular Formula	`C19H22N2O5S`
Molecular Weight	390.5 g/mol
Topological Polar Surface Area	127.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	390.12494
Heavy Atoms	27
Complexity	399.0

Chemical Identifiers

CAS Number	77711-41-2
SMILES	`C[NH+](C)CC(=O)N(C)C1=CC=C(C=C1)SC2=CC=CC=C2.C(=O)(C(=O)[O-])O`
InChIKey	`RADDYWORSKXIIB-UHFFFAOYSA-N`

📖 Product Overview

Compound C19H22N2O5S (CAS: 77711-41-2) is a chemical compound with molecular formula C19H22N2O5S and molecular weight 390.5 g/mol. Its IUPAC systematic name is dimethyl-[2-(N-methyl-4-phenylsulfanylanilino)-2-oxoethyl]azanium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 127.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 390.12494 Heavy Atoms 27 Complexity 399.0 InChI Key: RADDYWORSKXIIB-UHFFFAOYSA-N. SMILES: C[NH+](C)CC(=O)N(C)C1=CC=C(C=C1)SC2=CC=CC=C2.C(=O)(C(=O)[O-])O.

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