N-Diaminomethylene-2-ethyl-3-methylsulphonyl-4-phenylbenzamide

HCID 18976366
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Basic information

Standard SMILES
CCc1c(C(=O)N=C(N)N)ccc(-c2ccccc2)c1S(C)(=O)=O
InChIKey
FJOOYRCQANEWMT-UHFFFAOYSA-N
Molecular formula
C17H19N3O3S
Average molar mass
345.4 g/mol
Monoisotopic mass
345.11471265

Names & identifiers

Preferred name
N-Diaminomethylene-2-ethyl-3-methylsulphonyl-4-phenylbenzamide
IUPAC
N-(diaminomethylidene)-2-ethyl-3-methylsulfonyl-4-phenylbenzamide

Names & synonyms

SCHEMBL8529748FJOOYRCQANEWMT-UHFFFAOYSA-NN-Diaminomethylene-2-ethyl-3-methylsulphonyl-4-phenylbenzamide

Database identifiers

PubChem CID
18976366

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
124 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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