methyl 1-[5-acetamido-2-[2-(6-methylpyridin-3-yl)sulfonylpropanoylamino]-4-oxidanyl-phenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 1-[5-acetamido-2-[2-(6-methylpyridin-3-yl)sulfonylpropanoylamino]-4-oxidanyl-phenyl]pyrazole-4-carboxylate Openeye Name: methyl 1-[5-acetamido-4-hydroxy-2-[2-[(6-methyl-3-pyridyl)sulfonyl]propanoylamino]phenyl]pyrazole-4-carboxylate CAS Name: 1-[5-acetamido-4-hydroxy-2-[[2-[(6-methyl-3-pyridinyl)sulfonyl]-1-oxopropyl]amino]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[5-acetamido-4-hydroxy-2-[2-(6-methylpyridin-3-yl)sulfonylpropanoylamino]phenyl]pyrazole-4-carboxylate Traditional Name: 1-[5-acetamido-4-hydroxy-2-[2-[(6-methyl-3-pyridyl)sulfonyl]propanoylamino]phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C22H23N5O7S MolecularWeight: 501.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)S(=O)(=O)C(C)C(=O)NC2=CC(=C(C=C2N3C=C(C=N3)C(=O)OC)NC(=O)C)O

Isomeric SMILES

CC1=NC=C(C=C1)S(=O)(=O)C(C)C(=O)NC2=CC(=C(C=C2N3C=C(C=N3)C(=O)OC)NC(=O)C)O

InChI

InChI=1S/C22H23N5O7S/c1-12-5-6-16(10-23-12)35(32,33)13(2)21(30)26-17-8-20(29)18(25-14(3)28)7-19(17)27-11-15(9-24-27)22(31)34-4/h5-11,13,29H,1-4H3,(H,25,28)(H,26,30)