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Details

Stereochemistry ACHIRAL
Molecular Formula C23H25N3O4S.CH4O3S
Molecular Weight 535.633
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of INO-1001

SMILES

CS(O)(=O)=O.O=C1NC2=C(CC3=CC(=CC=C23)S(=O)(=O)NCCCN4CCOCC4)C5=CC=CC=C15

InChI

InChIKey=ICMWGKNAXGUKQN-UHFFFAOYSA-N
InChI=1S/C23H25N3O4S.CH4O3S/c27-23-20-5-2-1-4-19(20)21-15-16-14-17(6-7-18(16)22(21)25-23)31(28,29)24-8-3-9-26-10-12-30-13-11-26;1-5(2,3)4/h1-2,4-7,14,24H,3,8-13,15H2,(H,25,27);1H3,(H,2,3,4)

HIDE SMILES / InChI

Approval Year