U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H35ClN6O2S
Molecular Weight 519.102
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Tambiciclib

SMILES

COC[C@@H](C)N[C@H]1CC[C@@H](CC1)NC2=NC=C(Cl)C(=C2)C3=CSC(NCC4(CCOCC4)C#N)=N3

InChI

InChIKey=PGVNLOUNSPQGJP-GUDVDZBRSA-N
InChI=1S/C25H35ClN6O2S/c1-17(13-33-2)30-18-3-5-19(6-4-18)31-23-11-20(21(26)12-28-23)22-14-35-24(32-22)29-16-25(15-27)7-9-34-10-8-25/h11-12,14,17-19,30H,3-10,13,16H2,1-2H3,(H,28,31)(H,29,32)/t17-,18-,19-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
tambiciclib [INN]
Preferred Name English
Tambiciclib
INN  
Official Name English
4-(((4-(5-CHLORO-2-((TRANS-4-(((1R)-2-METHOXY-1-METHYL ETHYL)AMINO)CYCLOHEXYL)AMINO)-4-PYRIDINYL)-2-THIAZOLYL)AMINO)METHYL)TETRAHYDRO-2H-PYRAN-4-CARBONITRILE
Systematic Name English
2H-PYRAN-4-CARBONITRILE, 4-(((4-(5-CHLORO-2-((TRANS-4-(((1R)-2-METHOXY-1-METHYLETHYL)AMINO)CYCLOHEXYL)AMINO)-4-PYRIDINYL)-2-THIAZOLYL)AMINO)METHYL)TETRAHYDRO-
Systematic Name English
Code System Code Type Description
FDA UNII
XDZ7VK8CXC
Created by admin on Wed Apr 02 07:07:40 GMT 2025 , Edited by admin on Wed Apr 02 07:07:40 GMT 2025
PRIMARY
INN
12862
Created by admin on Wed Apr 02 07:07:40 GMT 2025 , Edited by admin on Wed Apr 02 07:07:40 GMT 2025
PRIMARY
CAS
2247481-08-7
Created by admin on Wed Apr 02 07:07:40 GMT 2025 , Edited by admin on Wed Apr 02 07:07:40 GMT 2025
PRIMARY
SMS_ID
300000054137
Created by admin on Wed Apr 02 07:07:40 GMT 2025 , Edited by admin on Wed Apr 02 07:07:40 GMT 2025
PRIMARY
NCI_THESAURUS
C206999
Created by admin on Wed Apr 02 07:07:40 GMT 2025 , Edited by admin on Wed Apr 02 07:07:40 GMT 2025
PRIMARY