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Details

Stereochemistry ACHIRAL
Molecular Formula C19H15Cl2N5O
Molecular Weight 400.261
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-Chloro-6-(2-chlorophenyl)-N,N-dimethyl-4H-[1,2,4]triazolo[1,5-a][1,4]benzodiazepine-2-carboxamide

SMILES

CN(C)C(=O)C1=NN2C(CN=C(C3=CC=CC=C3Cl)C4=CC(Cl)=CC=C24)=N1

InChI

InChIKey=YMJXPUGNWIWFJI-UHFFFAOYSA-N
InChI=1S/C19H15Cl2N5O/c1-25(2)19(27)18-23-16-10-22-17(12-5-3-4-6-14(12)21)13-9-11(20)7-8-15(13)26(16)24-18/h3-9H,10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C19H15Cl2N5O
Molecular Weight 400.261
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
242T8WV28A
Record Status Validated (UNII)
Record Version