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Details

Stereochemistry ACHIRAL
Molecular Formula C21H30N6O4S
Molecular Weight 462.566
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-ETHOXY-N-(2-(ETHYLAMINO)ETHYL)-3-(5-METHYL-4-OXO-7-PROPYL-3H-IMIDAZO(5,1-F)(1,2,4)TRIAZIN-2-YL)BENZENESULFONAMIDE

SMILES

CCCC1=NC(C)=C2N1N=C(NC2=O)C3=C(OCC)C=CC(=C3)S(=O)(=O)NCCNCC

InChI

InChIKey=MSEARHDZZNXCOY-UHFFFAOYSA-N
InChI=1S/C21H30N6O4S/c1-5-8-18-24-14(4)19-21(28)25-20(26-27(18)19)16-13-15(9-10-17(16)31-7-3)32(29,30)23-12-11-22-6-2/h9-10,13,22-23H,5-8,11-12H2,1-4H3,(H,25,26,28)

HIDE SMILES / InChI

Molecular Formula C21H30N6O4S
Molecular Weight 462.566
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
5W2L2F6HYQ
Record Status Validated (UNII)
Record Version