N-(3,5-dimethylphenyl)-2-[(2-methylphenyl)methylsulfanyl]acetamide

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Basic information

CAS: 425415-45-8
Standard SMILES: Cc1cc(C)cc(NC(=O)CSCc2ccccc2C)c1
InChIKey: UNPNURWWABRVBJ-UHFFFAOYSA-N
Molecular formula: C18H21NOS
Average molar mass: 299.4 g/mol
Monoisotopic mass: 299.13438547

Names & identifiers

Preferred name: N-(3,5-dimethylphenyl)-2-[(2-methylphenyl)methylsulfanyl]acetamide
IUPAC: N-(3,5-dimethylphenyl)-2-[(2-methylphenyl)methylsulfanyl]acetamide

Names & synonyms

N-(3,5-dimethylphenyl)-2-[(2-methylphenyl)methylsulfanyl]acetamideDTXSID90977257N-(3,5-Dimethylphenyl)-2-{[(2-methylphenyl)methyl]sulfanyl}ethanimidic acid425415-45-8AB00103318-01N-(3,5-dimethylphenyl)-2-[(2-methylbenzyl)thio]acetamideN-(3,5-Dimethylphenyl){[(2-methylphenyl)methyl]sulfanyl}ethanimidic acid

Database identifiers

CAS: 425415-45-8、6169-29-5
PubChem CID: 875265
DTXSID: DTXSID90977257

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 54.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 21
Formal charge: 0
Complexity: 323

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