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(S)-tert-butyl 1-(6-cyano-9-((2-(trimethylsilyl)ethoxy)methyl)-9H-dipyrido[2,3-b;4',3'-d]pyrrol-4-yl)pyrrolidin-3-ylcarbamate

HCID 58365035
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N[C@H]1CCN(c2ccnc3c2c2cc(C#N)ncc2n3COCC[Si](C)(C)C)C1
InChIKey
DNPUUERGXPKEKN-SFHVURJKSA-N
Molecular formula
C26H36N6O3Si
Average molar mass
508.7 g/mol

Names & identifiers

Preferred name
(S)-tert-butyl 1-(6-cyano-9-((2-(trimethylsilyl)ethoxy)methyl)-9H-dipyrido[2,3-b;4',3'-d]pyrrol-4-yl)pyrrolidin-3-ylcarbamate
IUPAC
tert-butyl N-[(3S)-1-[4-cyano-8-(2-trimethylsilylethoxymethyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-13-yl]pyrrolidin-3-yl]carbamate

Names & synonyms

SCHEMBL2157350DNPUUERGXPKEKN-SFHVURJKSA-N(S)-tert-butyl 1-(6-cyano-9-((2-(trimethylsilyl)ethoxy)methyl)-9H-dipyrido[2,3-b;4',3'-d]pyrrol-4-yl)pyrrolidin-3-ylcarbamate

Database identifiers

PubChem CID
58365035

Properties

Computed structural properties

Topological polar surface area
105 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
36
Formal charge
0
Complexity
821

Related reactions

3 records
New reaction record
HRID 60273 reaction equation
HRID 60273As productuspto-grants-2016_09
HRID 60274 reaction equation
HRID 60274As reactantuspto-grants-2016_09
HRID 60310 reaction equation
HRID 60310As reactantuspto-grants-2016_09

Compound notes

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