1,1-Dimethylethyl N-[trans-4-[[2-[4-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1-piperazinyl]acetyl]amino]cyclohexyl]carbamate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H39N7O3
Molecular Weight	509.6437
Optical Activity	NONE
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,1-Dimethylethyl N-[trans-4-[[2-[4-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1-piperazinyl]acetyl]amino]cyclohexyl]carbamate

Structure Search

SMILES

CC1=CC=C(C=C1)C2=NC(=NN=C2)N3CCN(CC(=O)N[C@H]4CC[C@@H](CC4)NC(=O)OC(C)(C)C)CC3

InChI

InChIKey=NXKORGCFIFQWDO-HZCBDIJESA-N

InChI=1S/C27H39N7O3/c1-19-5-7-20(8-6-19)23-17-28-32-25(31-23)34-15-13-33(14-16-34)18-24(35)29-21-9-11-22(12-10-21)30-26(36)37-27(2,3)4/h5-8,17,21-22H,9-16,18H2,1-4H3,(H,29,35)(H,30,36)/t21-,22-

HIDE SMILES / InChI

Molecular Formula	C27H39N7O3
Molecular Weight	509.6437
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:04:34 GMT 2025` Edited by `admin` on `Wed Apr 02 21:04:34 GMT 2025`
Record UNII	8CT9B3CT38
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1-Dimethylethyl N-[trans-4-[[2-[4-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1-piperazinyl]acetyl]amino]cyclohexyl]carbamate

Systematic Name

English

Carbamic acid, N-[trans-4-[[2-[4-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1-piperazinyl]acetyl]amino]cyclohexyl]-, 1,1-dimethylethyl ester

Preferred Name

English

Code System Code Type Description

CAS

2765632-56-0

Created by admin on Wed Apr 02 21:04:34 GMT 2025 , Edited by admin on Wed Apr 02 21:04:34 GMT 2025

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FDA UNII

8CT9B3CT38

Created by admin on Wed Apr 02 21:04:34 GMT 2025 , Edited by admin on Wed Apr 02 21:04:34 GMT 2025

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