API0232537
Roflumilast
Rofecoxib is a nonsteroidal anti-inflammatory drug (NSAID), withdrawn from the market.
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CAS No.
162401-32-3
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Synonyms
Roflumilast; 162401-32-3; DAXAS
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CHEMBL ID
CHEMBL193240
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Molecule Type
Small molecule
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Compound CID
449193
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Molecular Weight (g/mol)
403.2
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Molecular Formula
C17H14Cl2F2N2O3
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InChI
InChI=1S/C17H14Cl2F2N2O3/c18-11-6-22-7-12(19)15(11)23-16(24)10-3-4-13(26-17(20)21)14(5-10)25-8-9-1-2-9/h3-7,9,17H,1-2,8H2,(H,22,23,24)
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InChIKey
MNDBXUUTURYVHR-UHFFFAOYSA-N
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SMILES
C1CC1COC2=C(C=CC(=C2)C(=O)NC3=C(C=NC=C3Cl)Cl)OC(F)F
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IUPAC Name
3-(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide
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Exact Mass (Da)
402.034954
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Monoisotopic Mass (Da)
402.034954
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