API0232285
Dasatinib
Dasatinib is an anticancer drug (TKI).
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CAS No.
302962-49-8
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Synonyms
Dasatinib; 302962-49-8; Sprycel
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CHEMBL ID
CHEMBL1421
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Molecule Type
Small molecule
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Compound CID
3062316
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Molecular Weight (g/mol)
488
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Molecular Formula
C22H26ClN7O2S
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InChI
InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
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InChIKey
ZBNZXTGUTAYRHI-UHFFFAOYSA-N
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SMILES
CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC(=N3)C)N4CCN(CC4)CCO
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IUPAC Name
N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide
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Exact Mass (Da)
487.155722
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Monoisotopic Mass (Da)
487.155722
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