N-[3-(methylsulfanyl)phenyl]-4-nitrobenzamide

HCID 873432
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Basic information

Standard SMILES
CSc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1
InChIKey
SDTCNLPDXMHECT-UHFFFAOYSA-N
Molecular formula
C14H12N2O3S
Average molar mass
288.32 g/mol

Names & identifiers

Preferred name
N-[3-(methylsulfanyl)phenyl]-4-nitrobenzamide
IUPAC
N-(3-methylsulfanylphenyl)-4-nitrobenzamide

Names & synonyms

Cambridge id 5946334SCHEMBL8710646SDTCNLPDXMHECT-UHFFFAOYSA-NSTL118344AKOS0032069544-Nitro-N-(3-methylthiophenyl)benzamideN-[3-(methylthio)phenyl]-4-nitrobenzamideN-[3-(methylsulfanyl)phenyl]-4-nitrobenzamideSR-01000224079SR-01000224079-1Z28149495

Database identifiers

PubChem CID
873432

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
100 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

Related reactions

1 records
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Compound notes

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