InChI=1S/C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/t28-,31-,32-,33-/m0/s1

【InChIKey】

InChIKey=NCDNCNXCDXHOMX-XGKFQTDJSA-N

【SMILES】

CC(C)c1nc(cs1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)NC(=O)OCc4cncs4)O

【MOL File】

RITONAVIR.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:4

H bond acceptor:11

XLogP3:6.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

4CML File

RITONAVIR.cml

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162990-01-4 RITONAVIR

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】