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Details

Stereochemistry RACEMIC
Molecular Formula C19H23NOS
Molecular Weight 313.457
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (11RS)-11-[3-(dimethylamino)propyl]-6,11-dihydrodibenzo[b,e]thiepin-11-ol

SMILES

CN(C)CCCC1(O)C2=CC=CC=C2CSC3=C1C=CC=C3

InChI

InChIKey=GIGQDDWBWCUOFZ-UHFFFAOYSA-N
InChI=1S/C19H23NOS/c1-20(2)13-7-12-19(21)16-9-4-3-8-15(16)14-22-18-11-6-5-10-17(18)19/h3-6,8-11,21H,7,12-14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C19H23NOS
Molecular Weight 313.457
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
PEG7TA9R6Z
Record Status Validated (UNII)
Record Version