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Details

Stereochemistry RACEMIC
Molecular Formula C42H38ClN3O5
Molecular Weight 700.221
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [7-Chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl] 2-methyl-4-[(2-methylbenzoyl)amino]benzoate

SMILES

CC1=C(C=CC=C1)C(=O)NC2=CC(C)=C(C=C2)C(=O)OC3CCCN(C(=O)C4=C(C)C=C(NC(=O)C5=C(C)C=CC=C5)C=C4)C6=C3C=C(Cl)C=C6

InChI

InChIKey=WXSUCXSXZGKWKI-UHFFFAOYSA-N
InChI=1S/C42H38ClN3O5/c1-25-10-5-7-12-32(25)39(47)44-30-16-18-34(27(3)22-30)41(49)46-21-9-14-38(36-24-29(43)15-20-37(36)46)51-42(50)35-19-17-31(23-28(35)4)45-40(48)33-13-8-6-11-26(33)2/h5-8,10-13,15-20,22-24,38H,9,14,21H2,1-4H3,(H,44,47)(H,45,48)

HIDE SMILES / InChI

Molecular Formula C42H38ClN3O5
Molecular Weight 700.221
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:18:08 GMT 2025
Edited
by admin
on Wed Apr 02 19:18:08 GMT 2025
Record UNII
FY4V7CSR9N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-Chloro-1-[4-(o-toluoylamino)-2-toluoyl]-1,2,3,4-tetrahydro-5H-1-benzazepin-5-yl 5-(o-toluoylamino)-2-toluate
Preferred Name English
[7-Chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl] 2-methyl-4-[(2-methylbenzoyl)amino]benzoate
Systematic Name English
7-chloro-1-[2-methyl-4-(2-methylphenylcarbonylamino)benzoyl]-1,2,3,4-tetrahydro-5H-1-benzazepin-5-yl 2-methyl-4-(2-methylphenylcarbonylamino)benzene-1-carboxylate
Systematic Name English
Code System Code Type Description
FDA UNII
FY4V7CSR9N
Created by admin on Wed Apr 02 19:18:08 GMT 2025 , Edited by admin on Wed Apr 02 19:18:08 GMT 2025
PRIMARY
PUBCHEM
58003435
Created by admin on Wed Apr 02 19:18:08 GMT 2025 , Edited by admin on Wed Apr 02 19:18:08 GMT 2025
PRIMARY