2-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[[(3-oxo-1-phenyl-butan-2-yl)carbamoylamino]methyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Molecular Formula:
C36H37N3O7S
InChI: InChI=1/C36H37N3O7S/c1-23(41)31(18-24-6-3-2-4-7-24)39-36(44)38-20-25-9-15-28(16-10-25)35-45-29(22-47-33-30(34(42)43)8-5-17-37-33)19-32(46-35)27-13-11-26(21-40)12-14-27/h2-17,29,31-32,35,40H,18-22H2,1H3,(H,42,43)(H2,38,39,44)/f/h38-39,42H
InChIKey: InChIKey=XKDZDIUJYGITOW-XPUMZYBACP
SMILES: CC(=O)C(CC1=CC=CC=C1)NC(=O)NCC2=CC=C(C=C2)C3OC(CC(O3)C4=CC=C(C=C4)CO)CSC5=C(C=CC=N5)C(=O)O
Names:
2-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[[(3-oxo-1-phenyl-butan-2-yl)carbamoylamino]methyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Registries:
PubChem CID 4086893
PubChem ID 6004628
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