N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-methylphenoxy)acetamide

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Basic information

CAS: 620560-88-5
Standard SMILES: Cc1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C2CCS(=O)(=O)C2)cc1
InChIKey: WZOQNISXDPKCLN-UHFFFAOYSA-N
Molecular formula: C22H28N2O4S
Average molar mass: 416.5 g/mol

Names & identifiers

Preferred name: N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-methylphenoxy)acetamide
IUPAC: N-[[4-(dimethylamino)phenyl]methyl]-N-(1,1-dioxothiolan-3-yl)-2-(4-methylphenoxy)acetamide
English name: N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-methylphenoxy)acetamide
Molecular formula: C22H28N2O4S
Molecular weight: 416.53

Names & synonyms

N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-methylphenoxy)acetamide620560-88-5SMR000034968MLS000077967MLS002582765CHEMBL1443854HMS2347G09STK704384AKOS001686608AKOS016083089SR-01000114103SR-01000114103-1

Show more names

Acetamide, N-[[4-(dimethylamino)phenyl]methyl]-2-(4-methylphenoxy)-N-(tetrahydro-1,1-dioxido-3-thienyl)-

N-(4-(dimethylamino)benzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(p-tolyloxy)acetamide

Database identifiers

CAS: 620560-88-5
ChEMBL: CHEMBL1443854

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 75.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 29
Formal charge: 0
Complexity: 630

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Compound notes

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