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N-(2-aminophenyl)-4-[3-[(4-methylphenyl)sulfonylamino]prop-1-enyl]benzamide

HCID 68978301
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1ccc(S(=O)(=O)NCC=Cc2ccc(C(=O)Nc3ccccc3N)cc2)cc1
InChIKey
YPRROXWPVNNEJG-UHFFFAOYSA-N
Molecular formula
C23H23N3O3S
Average molar mass
421.5 g/mol

Names & identifiers

Preferred name
N-(2-aminophenyl)-4-[3-[(4-methylphenyl)sulfonylamino]prop-1-enyl]benzamide
IUPAC
N-(2-aminophenyl)-4-[3-[(4-methylphenyl)sulfonylamino]prop-1-enyl]benzamide

Names & synonyms

SCHEMBL4260683

Database identifiers

PubChem CID
68978301

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
110 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
30
Formal charge
0
Complexity
672

Related reactions

1 records
New reaction record
HRID 201411 reaction equation
HRID 201411As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

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