Methyl 3-methylthio-2-acetamidocinnamate

HCID 54544409
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Basic information

Standard SMILES
COC(=O)C=Cc1cccc(SC)c1NC(C)=O
InChIKey
ZFNNYUGSEJEBDO-UHFFFAOYSA-N
Molecular formula
C13H15NO3S
Average molar mass
265.33 g/mol
Monoisotopic mass
265.07726451

Names & identifiers

Preferred name
Methyl 3-methylthio-2-acetamidocinnamate
IUPAC
methyl 3-(2-acetamido-3-methylsulfanylphenyl)prop-2-enoate

Names & synonyms

SCHEMBL6776390ZFNNYUGSEJEBDO-UHFFFAOYSA-Nmethyl 3-methylthio-2-acetamidocinnamate

Database identifiers

PubChem CID
54544409

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
80.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
18

Related reactions

1 records
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Compound notes

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