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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H21N3O6S
Molecular Weight 419.452
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Neracorvir

SMILES

CC1=CN2C(=C1)C(=O)NC3=CC(=CC=C3S2(=O)=O)C(=O)NCC[C@H]4COCCO4

InChI

InChIKey=OXJNOWPZKFUKNS-AWEZNQCLSA-N
InChI=1S/C19H21N3O6S/c1-12-8-16-19(24)21-15-9-13(2-3-17(15)29(25,26)22(16)10-12)18(23)20-5-4-14-11-27-6-7-28-14/h2-3,8-10,14H,4-7,11H2,1H3,(H,20,23)(H,21,24)/t14-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Neracorvir
INN  
Official Name English
Pyrrolo[1,2-b][1,2,5]benzothiadiazepine-8-carboxamide, N-[2-(2S)-1,4-dioxan-2-ylethyl]-10,11-dihydro-2-methyl-11-oxo-, 5,5-dioxide
Systematic Name English
neracorvir [INN]
Common Name English
N-{[2-(2S)-1,4-dioxan-2-yl]ethyl}-2-methyl-5,5,11-trioxo-10,11-dihydro-5λ6H-pyrrolo[1,2-b][1,2,5]benzothiadiazepine-8-carboxamide
Systematic Name English
N-{2-[(2S)-1,4-Dioxan-2-yl]ethyl}-5-methyl-2,2,8-trioxo-2lambda6-thia-3,9-diazatricyclo[8.4.0.0{3,7}]tetradeca-1(10),4,6,11,13-pentaene-12-carboxamide
Systematic Name English
Code System Code Type Description
FDA UNII
Y8Z4GA5NQH
Created by admin on Sat Dec 16 19:36:41 GMT 2023 , Edited by admin on Sat Dec 16 19:36:41 GMT 2023
PRIMARY
INN
12521
Created by admin on Sat Dec 16 19:36:41 GMT 2023 , Edited by admin on Sat Dec 16 19:36:41 GMT 2023
PRIMARY
NCI_THESAURUS
C199075
Created by admin on Sat Dec 16 19:36:41 GMT 2023 , Edited by admin on Sat Dec 16 19:36:41 GMT 2023
PRIMARY
CAS
2243162-66-3
Created by admin on Sat Dec 16 19:36:41 GMT 2023 , Edited by admin on Sat Dec 16 19:36:41 GMT 2023
PRIMARY
PUBCHEM
146416094
Created by admin on Sat Dec 16 19:36:41 GMT 2023 , Edited by admin on Sat Dec 16 19:36:41 GMT 2023
PRIMARY