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Structure

1,3-Dibenzyl-1-(7-chlorothiazolo[5,4-d]pyrimidin-2-yl)thiourea

CAS
871266-88-5
Catalog Number
ACM871266885
Category
Other Products
Molecular Weight
425.957540 [g/mol]
Molecular Formula
C20H16ClN5S2

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Specification

Synonyms
AmbTiD60056, MolPort-000-003-342, ZINC26897062, CID11539152, D60056, 1,3-Dibenzyl-1-(7-chlorothiazolo[5,4-d]pyrimidin-2-yl)thiourea, 1,3-dibenzyl-1-(2-chloro-7-thia-3,5,9-triazabicyclo[4.3.0]nona-2,4,8,10-tetraen-8-yl)thiourea, 871266-88-5
IUPAC Name
1,3-dibenzyl-1-(7-chloro-[1,3]thiazolo[5,4-d]pyrimidin-2-yl)thiourea
Canonical SMILES
C1=CC=C(C=C1)CNC(=S)N(CC2=CC=CC=C2)C3=NC4=C(S3)N=CN=C4Cl
InChI Key
GMRJTVNCPZHTOX-UHFFFAOYSA-N
Boiling Point
597.108ºC at 760 mmHg
Flash Point
314.92ºC
Density
1.447g/cm³
Exact Mass
425.05400
H-Bond Acceptor
3
H-Bond Donor
1
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