YIMITASVIR

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C49H58N8O6
Molecular Weight	855.0348
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C2=NC=C(N2)C3=CC=C(C=C3)C4=C5[C@@H]6CC[C@@H](C6)C5=C(C=C4)C7=CC8=C(C=C7)N=C(N8)[C@@H]9CCCN9C(=O)[C@@H](NC(=O)OC)C(C)C

InChI

InChIKey=CMLNPOWEANUBIB-XIGHHNHFSA-N

InChI=1S/C49H58N8O6/c1-26(2)42(54-48(60)62-5)46(58)56-21-7-9-38(56)44-50-25-37(53-44)29-13-11-28(12-14-29)33-18-19-34(41-32-16-15-31(23-32)40(33)41)30-17-20-35-36(24-30)52-45(51-35)39-10-8-22-57(39)47(59)43(27(3)4)55-49(61)63-6/h11-14,17-20,24-27,31-32,38-39,42-43H,7-10,15-16,21-23H2,1-6H3,(H,50,53)(H,51,52)(H,54,60)(H,55,61)/t31-,32+,38+,39+,42+,43+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

YIMITASVIR

Common Name

English

CARBAMIC ACID, N-((1S)-2-METHYL-1-(((2S)-2-(5-(4-((1S,4R)-1,2,3,4-TETRAHYDRO-8-(2-((2S)-1-((2S)-2-((METHOXYCARBONYL)AMINO)-3-METHYL-1-OXOBUTYL)-2-PYRROLIDINYL)-1H-BENZIMIDAZOL-6-YL)-1,4-METHANONAPHTHALEN-5-YL)PHENYL)-1H-IMIDAZOL-2-YL)-1-PYRROLIDINYL)CARB

Code

English

DAG-181

Code

English

DAG181

Code

English

Code System Code Type Description

CAS

2230709-28-9

Created by admin on Sat Dec 16 18:23:57 GMT 2023 , Edited by admin on Sat Dec 16 18:23:57 GMT 2023

NO STRUCTURE GIVEN

CAS

1959593-23-7

Created by admin on Sat Dec 16 18:23:57 GMT 2023 , Edited by admin on Sat Dec 16 18:23:57 GMT 2023

PRIMARY

FDA UNII

K465JAH79P

Created by admin on Sat Dec 16 18:23:57 GMT 2023 , Edited by admin on Sat Dec 16 18:23:57 GMT 2023

PRIMARY

PUBCHEM

121427236

Created by admin on Sat Dec 16 18:23:57 GMT 2023 , Edited by admin on Sat Dec 16 18:23:57 GMT 2023

PRIMARY

ACTIVE MOIETY


					K465JAH79P

YIMITASVIR

SALT/SOLVATE (PARENT)


					7HJK69JC34

YIMITASVIR PHOSPHATE