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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H24ClN7OS
Molecular Weight 421.947
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Batoprotafib

SMILES

C[C@@H]1OCC2(CCN(CC2)C3=NC(N)=C(SC4=C(Cl)C(N)=NC=C4)N=C3)[C@@H]1N

InChI

InChIKey=UCJZOKGUEJUNIO-IINYFYTJSA-N
InChI=1S/C18H24ClN7OS/c1-10-14(20)18(9-27-10)3-6-26(7-4-18)12-8-24-17(16(22)25-12)28-11-2-5-23-15(21)13(11)19/h2,5,8,10,14H,3-4,6-7,9,20H2,1H3,(H2,21,23)(H2,22,25)/t10-,14+/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H24ClN7OS
Molecular Weight 421.947
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

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