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Details

Stereochemistry ACHIRAL
Molecular Formula C11H12BrN5S
Molecular Weight 326.215
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2-AMINOETHYL)-N'-(5-BROMO-6-QUINOXALINYL)THIOUREA

SMILES

NCCNC(=S)NC1=C(Br)C2=NC=CN=C2C=C1

InChI

InChIKey=PKKDYWFVHATGII-UHFFFAOYSA-N
InChI=1S/C11H12BrN5S/c12-9-7(17-11(18)16-4-3-13)1-2-8-10(9)15-6-5-14-8/h1-2,5-6H,3-4,13H2,(H2,16,17,18)

HIDE SMILES / InChI

Molecular Formula C11H12BrN5S
Molecular Weight 326.215
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
9WA6NGH9DR
Record Status Validated (UNII)
Record Version