Analyte Name

Des(isopropylthiazolyl)-N-methyl Ritonavir

CAS Number

959351-57-6

Molecular Formula

C31H41N5O5S

Molecular Weight

595.75

Accurate Mass

595.28

SMILES

O=C(OCC1=CN=CS1)N[C@@H](CC2=CC=CC=C2)[C@@H](O)C[C@H](CC3=CC=CC=C3)NC(C(NC(N(C)C)=O)C(C)C)=O

InChI

InChI=1S/C31H41N5O5S/c1-21(2)28(35-30(39)36(3)4)29(38)33-24(15-22-11-7-5-8-12-22)17-27(37)26(16-23-13-9-6-10-14-23)34-31(40)41-19-25-18-32-20-42-25/h5-14,18,20-21,24,26-28,37H,15-17,19H2,1-4H3,(H,33,38)(H,34,40)(H,35,39)/t24-,26-,27-,28?/m0/s1

IUPAC

thiazol-5-ylmethyl ((2S,3S,5S)-5-(2-(3,3-dimethylureido)-3-methylbutanamido)-3-hydroxy-1,6-diphenylhexan-2-yl)carbamate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat