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Details

Stereochemistry ACHIRAL
Molecular Formula C27H31F3N4O7S
Molecular Weight 612.618
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RS-102221

SMILES

COC1=CC(OC)=C(C=C1NS(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)C(=O)CCCCN3CCC4(CC3)NC(=O)NC4=O

InChI

InChIKey=HZZZZODVDSHQRG-UHFFFAOYSA-N
InChI=1S/C27H31F3N4O7S/c1-40-22-16-23(41-2)20(33-42(38,39)18-8-6-17(7-9-18)27(28,29)30)15-19(22)21(35)5-3-4-12-34-13-10-26(11-14-34)24(36)31-25(37)32-26/h6-9,15-16,33H,3-5,10-14H2,1-2H3,(H2,31,32,36,37)

HIDE SMILES / InChI

Molecular Formula C27H31F3N4O7S
Molecular Weight 612.618
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
48D22QR8GY
Record Status Validated (UNII)
Record Version