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Details

Stereochemistry RACEMIC
Molecular Formula C16H16O3S
Molecular Weight 288.361
Optical Activity ( + / - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MODAFINIL ESTER

SMILES

COC(=O)C[S@+]([O-])C(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=JFMZFATUMFWKEA-FQEVSTJZSA-N
InChI=1S/C16H16O3S/c1-19-15(17)12-20(18)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16O3S
Molecular Weight 288.361
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:34:22 UTC 2023
Edited
by admin
on Thu Jul 06 23:34:22 UTC 2023
Record UNII
5BAP7W5TXD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MODAFINIL ESTER
Common Name English
METHYL 2-((DIPHENYLMETHYL)SULFINYL)ACETATE
Systematic Name English
2-((DIPHENYLMETHYL)SULFINYL)ACETIC ACID METHYL ESTER
Systematic Name English
METHYL ((RS)-(DIPHENYLMETHYL)SULFINYL)ACETATE
Systematic Name English
ACETIC ACID, ((DIPHENYLMETHYL)SULFINYL)-, METHYL ESTER
Systematic Name English
MODAFINIL CARBOXYLATE METHYL ESTER
Common Name English
ACETIC ACID, 2-((DIPHENYLMETHYL)SULFINYL)-, METHYL ESTER
Systematic Name English
METHYL (BENZHYDRYLSULFINYL)ACETATE
Common Name English
MODAFINIL IMPURITY C [EP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40434643
Created by admin on Thu Jul 06 23:34:23 UTC 2023 , Edited by admin on Thu Jul 06 23:34:23 UTC 2023
PRIMARY
FDA UNII
5BAP7W5TXD
Created by admin on Thu Jul 06 23:34:23 UTC 2023 , Edited by admin on Thu Jul 06 23:34:23 UTC 2023
PRIMARY
PUBCHEM
29984875
Created by admin on Thu Jul 06 23:34:23 UTC 2023 , Edited by admin on Thu Jul 06 23:34:23 UTC 2023
PRIMARY
CAS
63547-25-1
Created by admin on Thu Jul 06 23:34:23 UTC 2023 , Edited by admin on Thu Jul 06 23:34:23 UTC 2023
PRIMARY
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