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Discontinued
C21H21ClN4O3S | 2-[3-(4-chlorophenyl)-5-[({[3-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]-4H-1,2,4-triazol-4-yl]acetic acid
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IUPAC traditional

2-[3-(4-chlorophenyl)-5-[({[3-(propan-2-yl)phenyl]carbamoyl}methyl)sulfanyl]-4H-1,2,4-triazol-4-yl]acetic acid

Molecular formula C21H21ClN4O3S
Molecular weight 444.93
DMSO solubility Unknown
SMILES CC(C)c1cccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2CC(O)=O)c1
Compound number Molport-005-370-001
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More Information

Compound Identifiers

Compound number
Molport-005-370-001

Names, Synonyms and 3rd Party Identifiers

InChI

InChI
1/C21H21ClN4O3S/c1-13(2)15-4-3-5-17(10-15)23-18(27)12-30-21-25-24-20(26(21)11-19(28)29)14-6-8-16(22)9-7-14/h3-10,13H,11-12H2,1-2H3,(H,23,27)(H,28,29)
InChI key
KIGATZWWVYJTFK-UHFFFAOYSA-N

Formula

Molecular formula
C21H21ClN4O3S
Molecular weight
444.93

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