2-{[(2,4-dimethylphenyl)sulfanyl]methyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylic acid

Compound number
MolPort-005-350-099
IUPAC
2-{[(2,4-dimethylphenyl)sulfanyl]methyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylic acid
IUPAC traditional
2-{[(2,4-dimethylphenyl)sulfanyl]methyl}-4-oxo-3H-quinazoline-7-carboxylic acid
SMILES
Cc1ccc(SCc2nc3cc(ccc3c(=O)[nH]2)C(O)=O)c(C)c1
InChI key
JORNLVMBVFLLRI-UHFFFAOYSA-N
Molecular formula
Molecular weight
340.4
DMSO Solubility
Not known

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Compound identifiers

Compound number
MolPort-005-350-099

Names, Synonyms and 3rd Party Identifiers

InChI

InChI
1/C18H16N2O3S/c1-10-3-6-15(11(2)7-10)24-9-16-19-14-8-12(18(22)23)4-5-13(14)17(21)20-16/h3-8H,9H2,1-2H3,(H,22,23)(H,19,20,21)
InChI key
JORNLVMBVFLLRI-UHFFFAOYSA-N

Formula

Molecular formula
C18H16N2O3S
Molecular weight
340.4

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