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Details

Stereochemistry ACHIRAL
Molecular Formula C16H22N4O3S
Molecular Weight 350.436
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAFENSTROLE

SMILES

CCN(CC)C(=O)N1C=NC(=N1)S(=O)(=O)C2=C(C)C=C(C)C=C2C

InChI

InChIKey=HFEJHAAIJZXXRE-UHFFFAOYSA-N
InChI=1S/C16H22N4O3S/c1-6-19(7-2)16(21)20-10-17-15(18-20)24(22,23)14-12(4)8-11(3)9-13(14)5/h8-10H,6-7H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C16H22N4O3S
Molecular Weight 350.436
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

PubMed

Patents

Substance Class Chemical
Record UNII
II8JP4LY7A
Record Status Validated (UNII)
Record Version