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Details

Stereochemistry MIXED
Molecular Formula C20H20Cl2N4O5S
Molecular Weight 499.368
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFINYL)-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOL-4-YL)-1,2-PROPANEDIOL

SMILES

CC(O)(CO)C1=C(N(CC2=CC=NC=C2)C(COC(N)=O)=N1)[S+]([O-])C3=CC(Cl)=CC(Cl)=C3

InChI

InChIKey=NSACELCXKZQXTE-UHFFFAOYSA-N
InChI=1S/C20H20Cl2N4O5S/c1-20(29,11-27)17-18(32(30)15-7-13(21)6-14(22)8-15)26(9-12-2-4-24-5-3-12)16(25-17)10-31-19(23)28/h2-8,27,29H,9-11H2,1H3,(H2,23,28)

HIDE SMILES / InChI

Molecular Formula C20H20Cl2N4O5S
Molecular Weight 499.368
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
WA2E3EQT7T
Record Status Validated (UNII)
Record Version