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CAS Number: 1004316-18-0
thiazol-5-ylmethyl ((2R,5R)-5-amino-1,6-diphenylhexan-2-yl)carbamate

Structure

thiazol-5-ylmethyl ((2R,5R)-5-amino-1,6-diphenylhexan-2-yl)carbamate
Name: thiazol-5-ylmethyl ((2R,5R)-5-amino-1,6-diphenylhexan-2-yl)carbamate
Synonyms:
General Information
Product Number: 1004316180

CAS Registry Number 1004316-18-0
Name:
Carbamic acid, N-​[(1R,​4R)​-​4-​amino-​5-​phenyl-​1-​(phenylmethyl)​pentyl]​-​, 5-​thiazolylmethyl ester

 

Chemical Formula: C23H27N3O2S
Exact Mass: 409.18
Molecular Weight: 409.54
m/z: 409.18 (100.0%), 410.19 (25.3%), 411.18 (4.8%), 411.19 (3.7%), 410.18 (1.9%), 412.18 (1.2%)

 

InChI:InChI=1S/C34H45N3O3/c1-21-22(2)32-27(23(3)31(21)38)13-16-34(4,40-32)33(39)36-26-11-9-24(10-12-26)20-37-17-14-25(15-18-37)29-19-35-30-8-6-5-7-28(29)30/h5-8,19,24-26,35,38H,9-18,20H2,1-4H3,(H,36,39)/t24?,26?,34-/m1/s1

InChI Key:RIAMPRYEHMJXKS-ORNRTLMXSA-N

Canonical SMILES:CC1=C(C(=C2CCC(OC2=C1C)(C)C(=O)NC3CCC(CC3)CN4CCC(CC4)C5=CNC6=CC=CC=C65)C)O

Specification

98%

References

(1) Xu, Lianhong; ACS Medicinal Chemistry Letters 2010, V1(5), P209-213 CAPLUS

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