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Details

Stereochemistry ACHIRAL
Molecular Formula C31H37N5O3.ClH
Molecular Weight 564.118
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2,4-BIS(1-METHYLETHYL)-3-PYRIDINYL)-N'-(1-BUTYL-1,2-DIHYDRO-4-(3-METHOXYPHENYL)-2-OXO-1,8-NAPHTHYRIDIN-3-YL)UREA HYDROCHLORIDE

SMILES

Cl.CCCCN1C(=O)C(NC(=O)NC2=C(C=CN=C2C(C)C)C(C)C)=C(C3=CC(OC)=CC=C3)C4=C1N=CC=C4

InChI

InChIKey=CXGSABGLRQYOCH-UHFFFAOYSA-N
InChI=1S/C31H37N5O3.ClH/c1-7-8-17-36-29-24(13-10-15-33-29)25(21-11-9-12-22(18-21)39-6)28(30(36)37)35-31(38)34-27-23(19(2)3)14-16-32-26(27)20(4)5;/h9-16,18-20H,7-8,17H2,1-6H3,(H2,34,35,38);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C31H37N5O3
Molecular Weight 527.6572
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:16:52 UTC 2023
Edited
by admin
on Sat Dec 16 08:16:52 UTC 2023
Record UNII
9G8S8RL1EO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2,4-BIS(1-METHYLETHYL)-3-PYRIDINYL)-N'-(1-BUTYL-1,2-DIHYDRO-4-(3-METHOXYPHENYL)-2-OXO-1,8-NAPHTHYRIDIN-3-YL)UREA HYDROCHLORIDE
Systematic Name English
UREA, N-(2,4-BIS(1-METHYLETHYL)-3-PYRIDINYL)-N'-(1-BUTYL-1,2-DIHYDRO-4-(3-METHOXYPHENYL)-2-OXO-1,8-NAPHTHYRIDIN-3-YL)-, HYDROCHLORIDE (1:1)
Systematic Name English
UREA, N-(2,4-BIS(1-METHYLETHYL)-3-PYRIDINYL)-N'-(1-BUTYL-1,2-DIHYDRO-4-(3-METHOXYPHENYL)-2-OXO-1,8-NAPHTHYRIDIN-3-YL)-, MONOHYDROCHLORIDE
Common Name English
Code System Code Type Description
CAS
873194-77-5
Created by admin on Sat Dec 16 08:16:52 UTC 2023 , Edited by admin on Sat Dec 16 08:16:52 UTC 2023
PRIMARY
PUBCHEM
45263327
Created by admin on Sat Dec 16 08:16:52 UTC 2023 , Edited by admin on Sat Dec 16 08:16:52 UTC 2023
PRIMARY
FDA UNII
9G8S8RL1EO
Created by admin on Sat Dec 16 08:16:52 UTC 2023 , Edited by admin on Sat Dec 16 08:16:52 UTC 2023
PRIMARY