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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H21ClN4O2
Molecular Weight 360.838
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Dimethylethyl N-[(1S)-2-[3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl]-1-methylethyl]carbamate

SMILES

C[C@@H](CN1C=CC(=N1)C2=CC(Cl)=C(C=C2)C#N)NC(=O)OC(C)(C)C

InChI

InChIKey=XFORCNZKSQSJBX-LBPRGKRZSA-N
InChI=1S/C18H21ClN4O2/c1-12(21-17(24)25-18(2,3)4)11-23-8-7-16(22-23)13-5-6-14(10-20)15(19)9-13/h5-9,12H,11H2,1-4H3,(H,21,24)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H21ClN4O2
Molecular Weight 360.838
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:33:08 GMT 2023
Edited
by admin
on Sat Dec 16 19:33:08 GMT 2023
Record UNII
L894WCS6BN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,1-Dimethylethyl N-[(1S)-2-[3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl]-1-methylethyl]carbamate
Systematic Name English
Carbamic acid, N-[(1S)-2-[3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl]-1-methylethyl]-, 1,1-dimethylethyl ester
Systematic Name English
Code System Code Type Description
CAS
2415967-06-3
Created by admin on Sat Dec 16 19:33:08 GMT 2023 , Edited by admin on Sat Dec 16 19:33:08 GMT 2023
PRIMARY
PUBCHEM
149205774
Created by admin on Sat Dec 16 19:33:08 GMT 2023 , Edited by admin on Sat Dec 16 19:33:08 GMT 2023
PRIMARY
FDA UNII
L894WCS6BN
Created by admin on Sat Dec 16 19:33:08 GMT 2023 , Edited by admin on Sat Dec 16 19:33:08 GMT 2023
PRIMARY