N-(4-(5-((1R,2R)-2-(tert-Butyldimethylsilyloxy)-1-(3-chloro-4-cyano-2-methylphenylamino)propyl)-1,3,4-oxadiazol-2-yl)phenyl)butyramide

HCID 67006012

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CCCC(=O)Nc1ccc(-c2nnc([C@H](Nc3ccc(C#N)c(Cl)c3C)[C@@H](C)O[Si](C)(C)C(C)(C)C)o2)cc1
InChIKey: IQOXINQNONAYEI-NIYFSFCBSA-N
Molecular formula: C29H38ClN5O3Si
Average molar mass: 568.2 g/mol

Names & identifiers

Preferred name: N-(4-(5-((1R,2R)-2-(tert-Butyldimethylsilyloxy)-1-(3-chloro-4-cyano-2-methylphenylamino)propyl)-1,3,4-oxadiazol-2-yl)phenyl)butyramide
IUPAC: N-[4-[5-[(1R,2R)-2-[tert-butyl(dimethyl)silyl]oxy-1-(3-chloro-4-cyano-2-methylanilino)propyl]-1,3,4-oxadiazol-2-yl]phenyl]butanamide

Names & synonyms

SCHEMBL1363334IQOXINQNONAYEI-NIYFSFCBSA-NN-(4-(5-((1R,2R)-2-(tert-Butyldimethylsilyloxy)-1-(3-chloro-4-cyano-2-methylphenylamino)propyl)-1,3,4-oxadiazol-2-yl)phenyl)butyramide

Database identifiers

PubChem CID: 67006012

Properties

Computed structural properties

Topological polar surface area: 113 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 11
Heavy atoms: 39
Formal charge: 0
Complexity: 854

Related reactions

8 records

New reaction record

HRID 470874As productuspto-grants-2014_01

HRID 470875As reactantuspto-grants-2014_01

HRID 563338As productuspto-grants-2011_11

HRID 563339As reactantuspto-grants-2011_11

HRID 1254787As productuspto-grants-2013_06

HRID 1254788As reactantuspto-grants-2013_06

HRID 2388540As productuspto-grants-2012_09

HRID 2388541As reactantuspto-grants-2012_09

Compound notes

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