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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H20Cl2N2O5S
Molecular Weight 471.354
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[(5,7-Dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl)carbonyl]-3-(methylsulfonyl)-L-phenylalanine

SMILES

CS(=O)(=O)C1=CC=CC(C[C@H](NC(=O)C2=C(Cl)C=C3CNCCC3=C2Cl)C(O)=O)=C1

InChI

InChIKey=YUSRSRSJRRHCQF-INIZCTEOSA-N
InChI=1S/C20H20Cl2N2O5S/c1-30(28,29)13-4-2-3-11(7-13)8-16(20(26)27)24-19(25)17-15(21)9-12-10-23-6-5-14(12)18(17)22/h2-4,7,9,16,23H,5-6,8,10H2,1H3,(H,24,25)(H,26,27)/t16-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
N-[(5,7-Dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl)carbonyl]-3-(methylsulfonyl)-L-phenylalanine
Systematic Name English
L-Phenylalanine, N-[(5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl)carbonyl]-3-(methylsulfonyl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
59640823
Created by admin on Sat Dec 16 19:12:09 GMT 2023 , Edited by admin on Sat Dec 16 19:12:09 GMT 2023
PRIMARY
CAS
851785-70-1
Created by admin on Sat Dec 16 19:12:09 GMT 2023 , Edited by admin on Sat Dec 16 19:12:09 GMT 2023
PRIMARY
FDA UNII
26W92GBX25
Created by admin on Sat Dec 16 19:12:09 GMT 2023 , Edited by admin on Sat Dec 16 19:12:09 GMT 2023
PRIMARY