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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16N4S
Molecular Weight 236.337
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EVANDAMINE, (R)-

SMILES

C[C@@H]1CC(N)=NN1C2=NC3=C(CCCC3)S2

InChI

InChIKey=GINRFPGQEWNBJV-SSDOTTSWSA-N
InChI=1S/C11H16N4S/c1-7-6-10(12)14-15(7)11-13-8-4-2-3-5-9(8)16-11/h7H,2-6H2,1H3,(H2,12,14)/t7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H16N4S
Molecular Weight 236.337
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
69826NE6QS
Record Status Validated (UNII)
Record Version