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Details

Stereochemistry ACHIRAL
Molecular Formula C14H11N3S
Molecular Weight 253.322
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of YM-31636

SMILES

C(C1=CNC=N1)C2=NC3=C(CC4=C3C=CC=C4)S2

InChI

InChIKey=SWXJBBYBDXFMGG-UHFFFAOYSA-N
InChI=1S/C14H11N3S/c1-2-4-11-9(3-1)5-12-14(11)17-13(18-12)6-10-7-15-8-16-10/h1-4,7-8H,5-6H2,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C14H11N3S
Molecular Weight 253.322
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
K9K8W6KEH2
Record Status Validated (UNII)
Record Version