DIOX2_018953
Molecular Formula:
C27H29N5O3S
InChI: InChI=1/C27H29N5O3S/c1-32-27(29-30-31-32)36-17-24-14-25(20-10-8-18(16-33)9-11-20)35-26(34-24)23-7-3-6-22(13-23)21-5-2-4-19(12-21)15-28/h2-13,24-26,33H,14-17,28H2,1H3/t24-,25+,26+/m1/s1
InChIKey: InChIKey=FOQPQTDESSITMQ-ZNZIZOMTBQ
SMILES: CN1C(=NN=N1)SCC2CC(OC(O2)C3=CC=CC(=C3)C4=CC(=CC=C4)CN)C5=CC=C(C=C5)CO
Names:
DIOX2_018953
[4-[(2S,4S,6R)-2-[3-[3-(aminomethyl)phenyl]phenyl]-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1,3-dioxan-4-yl]phenyl]methanol
Registries:
PubChem CID 6700134
PubChem ID 11325952
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