U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C7H14N2O3S
Molecular Weight 206.263
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ALDICARB SULFOXIDE, Z-ISOMER

SMILES

CNC(=O)O\N=C/C(C)(C)[S+](C)[O-]

InChI

InChIKey=BXPMAGSOWXBZHS-UITAMQMPSA-N
InChI=1S/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5-

HIDE SMILES / InChI

Molecular Formula C7H14N2O3S
Molecular Weight 206.263
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
80Y520D22U
Record Status Validated (UNII)
Record Version