N'-(2-aminophenyl)-N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]heptanediamide
Molecular Formula:
C42H45N5O5S
InChI: InChI=1/C42H45N5O5S/c43-36-13-4-5-14-37(36)47-40(50)16-3-1-2-15-39(49)46-26-30-9-6-10-32(23-30)33-11-7-12-34(24-33)41-51-35(28-53-42-44-21-8-22-45-42)25-38(52-41)31-19-17-29(27-48)18-20-31/h4-14,17-24,35,38,41,48H,1-3,15-16,25-28,43H2,(H,46,49)(H,47,50)/f/h46-47H
InChIKey: InChIKey=DGVPWYWPNRDRKB-ZZNLRWNBCJ
SMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=CC(=C3)C4=CC(=CC=C4)CNC(=O)CCCCCC(=O)NC5=CC=CC=C5N)CSC6=NC=CC=N6
Names:
N'-(2-aminophenyl)-N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]heptanediamide
Registries:
PubChem CID 3567666
PubChem ID 4831389
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