ATAZANAVIR SULFATE

CAS No.
229975-97-7
CCD No.
CCD00622999
Formula
C38 H52 N6 O7 . H2 O4 S
MolWeight
802.942

Basic Information

Product Name: ATAZANAVIR SULFATE
CAS: 229975-97-7
English Synonyms: ATAZANAVIR SULPHATE ; METHYL N-[(2S)-1-[[(2S,3S)-3-HYDROXY-4-[[[(2S)-2-(METHOXYCARBONYLAMINO)-3,3-DIMETHYLBUTANOYL]AMINO]-[(4-PYRIDIN-2-YLPHENYL)METHYL]AMINO]-1-PHENYLBUTAN-2-YL]AMINO]-3,3-DIMETHYL-1-OXOBUTAN-2-YL]CARBAMATE SULFATE ; ZRIVADA ; ATAZANAVIR (SULFATE) ; REYATAZ ; BMS-232632-05 ; ATAZANAVIR SULFATE
MDL Number.: MFCD08067748
H bond acceptor: 13
H bond donor: 5
Smile: CC(C)(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)[C@H](CN(Cc2ccc(cc2)c3ccccn3)NC(=O)[C@H](C(C)(C)C)NC(=O)OC)O)NC(=O)OC.OS(=O)(=O)O
InChi: InChI=1S/C38H52N6O7.H2O4S/c1-37(2,3)31(41-35(48)50-7)33(46)40-29(22-25-14-10-9-11-15-25)30(45)24-44(43-34(47)32(38(4,5)6)42-36(49)51-8)23-26-17-19-27(20-18-26)28-16-12-13-21-39-28;1-5(2,3)4/h9-21,29-32,45H,22-24H2,1-8H3,(H,40,46)(H,41,48)(H,42,49)(H,43,47);(H2,1,2,3,4)/t29-,30-,31+,32+;/m0./s1
InChiKey: InChIKey=DQSGVVGOPRWTKI-QVFAWCHISA-N

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