N-(4-carboethoxyphenyl)-N'-(2,2-diethoxyethyl)thiourea

HCID 4842498
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Basic information

Standard SMILES
CCOC(=O)c1ccc(NC(=S)NCC(OCC)OCC)cc1
InChIKey
NDXGMZJZMXOOOK-UHFFFAOYSA-N
Molecular formula
C16H24N2O4S
Average molar mass
340.4 g/mol

Names & identifiers

Preferred name
N-(4-carboethoxyphenyl)-N'-(2,2-diethoxyethyl)thiourea
IUPAC
ethyl 4-(2,2-diethoxyethylcarbamothioylamino)benzoate

Names & synonyms

SCHEMBL10703240NDXGMZJZMXOOOK-UHFFFAOYSA-NAKOS030004747SR-01000067097SR-01000067097-1Z85923353N-(4-carboethoxyphenyl)-N'-(2,2-diethoxyethyl)thiourea

Database identifiers

PubChem CID
4842498
Nikkaji
J327.366K

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
101 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
23

Related reactions

2 records
New reaction record

Compound notes

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