Catalog Number:
AG00A0IT
Chemical Name:
XMD16-5
CAS Number:
1345098-78-3
Molecular Formula:
C23H24N6O2
Molecular Weight:
416.4757
MDL Number:
MFCD30738049
IUPAC Name:
2-[4-(4-hydroxypiperidin-1-yl)anilino]-11-methyl-5H-pyrimido[4,5-b][1,4]benzodiazepin-6-one
InChI:
InChI=1S/C23H24N6O2/c1-28-20-5-3-2-4-18(20)22(31)26-19-14-24-23(27-21(19)28)25-15-6-8-16(9-7-15)29-12-10-17(30)11-13-29/h2-9,14,17,30H,10-13H2,1H3,(H,26,31)(H,24,25,27)
InChI Key:
AGLKBEPKKDHHKY-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)c1ccc(cc1)Nc1ncc2c(n1)n(C)c1ccccc1c(=O)[nH]2
