3-Benzyl-2-mercapto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

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Catalog Number
ACM59898634
Product Name
3-Benzyl-2-mercapto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
Structure
Structure
CAS
59898-63-4
Category
Heterocyclic Organic Compound
Synonyms
Oprea1_331600, MolPort-000-220-548, MolPort-000-874-037, ZINC02768959, CID700118, UZI/9312626, AF-399/40862806, F1174-0471, 3-benzyl-5,6-dimethyl-2-thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one, 59898-63-4
IUPAC Name
3-benzyl-5,6-dimethyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one
Molecular Weight
302.414
Molecular Formula
C15H14N2OS2
Canonical SMILES
CC1=C(SC2=C1C(=O)N(C(=S)N2)CC3=CC=CC=C3)C
InChI Key
GUKGRFQNMDQCTN-UHFFFAOYSA-N
Boiling Point
491.2ºC at 760 mmHg
Flash Point
250.9ºC
Density
1.38g/cm³
Exact Mass
302.05500
H-Bond Acceptor
1
H-Bond Donor
1
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