U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H15N5
Molecular Weight 217.2703
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,6-DIAMINO-1,2-DIHYDRO-2,2-DIMETHYL-1-PHENYL-S-TRIAZINE

SMILES

CC1(C)N=C(N)N=C(N)N1C2=CC=CC=C2

InChI

InChIKey=VMVKLCXTXSSZSI-UHFFFAOYSA-N
InChI=1S/C11H15N5/c1-11(2)15-9(12)14-10(13)16(11)8-6-4-3-5-7-8/h3-7H,1-2H3,(H4,12,13,14,15)

HIDE SMILES / InChI

Molecular Formula C11H15N5
Molecular Weight 217.2703
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 13:26:44 GMT 2023
Edited
by admin
on Sat Dec 16 13:26:44 GMT 2023
Record UNII
31YM8O4QFT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,6-DIAMINO-1,2-DIHYDRO-2,2-DIMETHYL-1-PHENYL-S-TRIAZINE
Systematic Name English
1,3,5-TRIAZINE-2,4-DIAMINE, 1,6-DIHYDRO-6,6-DIMETHYL-1-PHENYL-
Systematic Name English
1,6-DIHYDRO-6,6-DIMETHYL-1-PHENYL-1,3,5-TRIAZINE-2,4-DIAMINE
Systematic Name English
S-TRIAZINE, 4,6-DIAMINO-1,2-DIHYDRO-2,2-DIMETHYL-1-PHENYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30193217
Created by admin on Sat Dec 16 13:26:44 GMT 2023 , Edited by admin on Sat Dec 16 13:26:44 GMT 2023
PRIMARY
PUBCHEM
19931
Created by admin on Sat Dec 16 13:26:44 GMT 2023 , Edited by admin on Sat Dec 16 13:26:44 GMT 2023
PRIMARY
CAS
4022-58-6
Created by admin on Sat Dec 16 13:26:44 GMT 2023 , Edited by admin on Sat Dec 16 13:26:44 GMT 2023
PRIMARY
FDA UNII
31YM8O4QFT
Created by admin on Sat Dec 16 13:26:44 GMT 2023 , Edited by admin on Sat Dec 16 13:26:44 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY