4-methyl-N-[methyl(propyl)-lambda~4~-sulfanylidene]benzenesulfonamide

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Basic information

CAS: 53799-66-9
Standard SMILES: CCC/S(C)=N/S(=O)(=O)c1ccc(C)cc1
InChIKey: DDRASJMBTGYRDJ-UHFFFAOYSA-N
Molecular formula: C11H17NO2S2
Average molar mass: 259.4 g/mol
Monoisotopic mass: 259.07007113

Overview

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Names & identifiers

Preferred name: 4-methyl-N-[methyl(propyl)-lambda~4~-sulfanylidene]benzenesulfonamide
IUPAC: (NE)-4-methyl-N-[methyl(propyl)-λ4-sulfanylidene]benzenesulfonamide

Names & synonyms

S-Methyl-S-propyl-N-(p-tolylsulfonyl)sulfimine4-methyl-N-[methyl(propyl)-lambda~4~-sulfanylidene]benzenesulfonamideHMS2557I19(NE)-4-methyl-N-[methyl(propyl)-lambda4-sulfanylidene]benzenesulfonamideNCGC00247243-01

Database identifiers

CAS: 53799-66-9
PubChem CID: 9554254
Nikkaji: J90.672G

Properties

Computed structural properties

XLogP: 3.6
Topological polar surface area: 74.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 335

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