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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H20ClNO4S
Molecular Weight 381.874
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-(2,3-bis(hydroxymethyl)-6,7-dihydrothieno[3,2-c] pyridin-5(4H)-yl)-2-(2-chlorophenyl)acetate, (S)-

SMILES

COC(=O)[C@@H](N1CCC2=C(C1)C(CO)=C(CO)S2)C3=C(Cl)C=CC=C3

InChI

InChIKey=FXTXHERUPPZXRF-KRWDZBQOSA-N
InChI=1S/C18H20ClNO4S/c1-24-18(23)17(11-4-2-3-5-14(11)19)20-7-6-15-12(8-20)13(9-21)16(10-22)25-15/h2-5,17,21-22H,6-10H2,1H3/t17-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Methyl 2-(2,3-bis(hydroxymethyl)-6,7-dihydrothieno[3,2-c] pyridin-5(4H)-yl)-2-(2-chlorophenyl)acetate, (S)-
Systematic Name English
Methyl (αS)-α-(2-chlorophenyl)-6,7-dihydro-2,3-bis(hydroxymethyl)thieno[3,2-c]pyridine-5(4H)-acetate
Systematic Name English
Thieno[3,2-c]pyridine-5(4H)-acetic acid, α-(2-chlorophenyl)-6,7-dihydro-2,3-bis(hydroxymethyl)-, methyl ester, (αS)-
Systematic Name English
(S)-Methyl 2-(2,3-bis(hydroxymethyl)-6,7-dihydrothieno[3,2-c] pyridin-5(4H)-yl)-2-(2-chlorophenyl)acetate
Systematic Name English
Code System Code Type Description
CAS
1346231-36-4
Created by admin on Sat Dec 16 19:47:00 GMT 2023 , Edited by admin on Sat Dec 16 19:47:00 GMT 2023
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FDA UNII
35GGP73TZV
Created by admin on Sat Dec 16 19:47:00 GMT 2023 , Edited by admin on Sat Dec 16 19:47:00 GMT 2023
PRIMARY
PUBCHEM
163202829
Created by admin on Sat Dec 16 19:47:00 GMT 2023 , Edited by admin on Sat Dec 16 19:47:00 GMT 2023
PRIMARY