N-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(2H-1,2,4-triazol-3-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide
Molecular Formula:
C44H45N5O6S2
InChI: InChI=1/C44H45N5O6S2/c1-29-12-22-37(23-13-29)57(52,53)49-39(24-31-8-4-3-5-9-31)42(51)45-25-36-10-6-7-11-38(36)33-18-20-35(21-19-33)43-54-40(27-56-44-46-28-47-48-44)30(2)41(55-43)34-16-14-32(26-50)15-17-34/h3-23,28,30,39-41,43,49-50H,24-27H2,1-2H3,(H,45,51)(H,46,47,48)/f/h45,48H
InChIKey: InChIKey=ZUNOIEYEKWRHOX-SUWMTADZCR
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC=CC=C4CNC(=O)C(CC5=CC=CC=C5)NS(=O)(=O)C6=CC=C(C=C6)C)CSC7=NC=NN7
Names:
N-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(2H-1,2,4-triazol-3-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide
Registries:
PubChem CID 4455111
PubChem ID 6567477
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