N-(1-Methylethyl)-N'-[2-[methyl(phenylmethyl)amino]ethyl]-N-[2-(phenylsulfonyl)ethyl]urea

HCID 20152874
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Basic information

Standard SMILES
CC(C)N(CCS(=O)(=O)c1ccccc1)C(=O)NCCN(C)Cc1ccccc1
InChIKey
PVVCTJIBTXBGGL-UHFFFAOYSA-N
Molecular formula
C22H31N3O3S
Average molar mass
417.6 g/mol

Names & identifiers

Preferred name
N-(1-Methylethyl)-N'-[2-[methyl(phenylmethyl)amino]ethyl]-N-[2-(phenylsulfonyl)ethyl]urea
IUPAC
1-[2-(benzenesulfonyl)ethyl]-3-[2-[benzyl(methyl)amino]ethyl]-1-propan-2-ylurea

Names & synonyms

SCHEMBL10685323PVVCTJIBTXBGGL-UHFFFAOYSA-NN-(1-Methylethyl)-N'-[2-[methyl(phenylmethyl)amino]ethyl]-N-[2-(phenylsulfonyl)ethyl]urea

Database identifiers

PubChem CID
20152874

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
78.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
29

Related reactions

3 records
New reaction record

Linked notes

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