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Details

Stereochemistry RACEMIC
Molecular Formula C17H17F2N3O4S
Molecular Weight 397.396
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N3-METHYL PANTOPRAZOLE

SMILES

COC1=C(OC)C(C[S+]([O-])C2=NC3=CC=C(OC(F)F)C=C3N2C)=NC=C1

InChI

InChIKey=FYIXLAGYOWZQJO-UHFFFAOYSA-N
InChI=1S/C17H17F2N3O4S/c1-22-13-8-10(26-16(18)19)4-5-11(13)21-17(22)27(23)9-12-15(25-3)14(24-2)6-7-20-12/h4-8,16H,9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C17H17F2N3O4S
Molecular Weight 397.396
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
X2LW553878
Record Status Validated (UNII)
Record Version