4-[[2,3-bis(fluoranyl)-6-methoxy-phenyl]carbonylamino]-N-(1-methylsulfonylpiperidin-4-yl)-1H-pyrazole-5-carboxamide

Systemtic Name: 4-[[2,3-bis(fluoranyl)-6-methoxy-phenyl]carbonylamino]-N-(1-methylsulfonylpiperidin-4-yl)-1H-pyrazole-5-carboxamide Openeye Name: 4-[(2,3-difluoro-6-methoxy-benzoyl)amino]-N-(1-methylsulfonyl-4-piperidyl)-1H-pyrazole-5-carboxamide CAS Name: 4-[[(2,3-difluoro-6-methoxyphenyl)-oxomethyl]amino]-N-(1-methylsulfonyl-4-piperidinyl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-[(2,3-difluoro-6-methoxybenzoyl)amino]-N-(1-methylsulfonylpiperidin-4-yl)-1H-pyrazole-5-carboxamide Traditional Name: 4-[(2,3-difluoro-6-methoxy-benzoyl)amino]-N-(1-mesyl-4-piperidyl)-1H-pyrazole-5-carboxamide Formula: C18H21F2N5O5S MolecularWeight: 457.451646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)F)F)C(=O)NC2=C(NN=C2)C(=O)NC3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C=C1)F)F)C(=O)NC2=C(NN=C2)C(=O)NC3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H21F2N5O5S/c1-30-13-4-3-11(19)15(20)14(13)17(26)23-12-9-21-24-16(12)18(27)22-10-5-7-25(8-6-10)31(2,28)29/h3-4,9-10H,5-8H2,1-2H3,(H,21,24)(H,22,27)(H,23,26)