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Structure

1-Mercapto-4-(3-methylphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one

CAS
67442-91-5
Catalog Number
ACM67442915
Category
Other Products
Molecular Weight
308.357680 [g/mol]
Molecular Formula
C16H12N4OS

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Specification

Synonyms
1-mercapto-4-(3-methylphenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one, 67442-91-5, AC1M6MJ2, AC1Q2H5J, CTK5C6175, MolPort-002-465-825, AKOS000116926, AG-G-55008, MCULE-4592489552, EN300-08202, T0518-2737, [1,2,4]Triazolo[4,3-a]quinazolin-5(1H)-one,2,4-dihydro-4-(3-methylphenyl)-1-thioxo-, 4-(3-methylphenyl)-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
IUPAC Name
4-(3-methylphenyl)-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Canonical SMILES
CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N4C2=NNC4=S
InChI Key
GIOHZUXLYXFUQU-UHFFFAOYSA-N
Boiling Point
475.1ºC at 760 mmHg
Flash Point
241.1ºC
Density
1.45g/cm³
Exact Mass
308.07300
H-Bond Acceptor
3
H-Bond Donor
1
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