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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H20N4O2
Molecular Weight 396.4412
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PD-168787

SMILES

CC1=CC2=C3N(CC2)C(=O)[C@H](NC(=O)C4=CC=NC=C4)N=C(C5=CC=CC=C5)C3=C1

InChI

InChIKey=KYFWUBJMTHVBIF-QFIPXVFZSA-N
InChI=1S/C24H20N4O2/c1-15-13-18-9-12-28-21(18)19(14-15)20(16-5-3-2-4-6-16)26-22(24(28)30)27-23(29)17-7-10-25-11-8-17/h2-8,10-11,13-14,22H,9,12H2,1H3,(H,27,29)/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H20N4O2
Molecular Weight 396.4412
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
Y4O6325SYW
Record Status Validated (UNII)
Record Version