N-[2-fluoranyl-4-(5-oxidanylidene-1,4-oxazepan-4-yl)phenyl]-5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxamide

Systemtic Name: N-[2-fluoranyl-4-(5-oxidanylidene-1,4-oxazepan-4-yl)phenyl]-5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxamide Openeye Name: N-[2-fluoro-4-(5-oxo-1,4-oxazepan-4-yl)phenyl]-5-methyl-2-(3-methylsulfonyl-2-naphthyl)pyrazole-3-carboxamide CAS Name: N-[2-fluoro-4-(5-oxo-1,4-oxazepan-4-yl)phenyl]-5-methyl-2-(3-methylsulfonyl-2-naphthalenyl)-3-pyrazolecarboxamide IUPAC Name: N-[2-fluoro-4-(5-oxo-1,4-oxazepan-4-yl)phenyl]-5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxamide Traditional Name: N-[2-fluoro-4-(5-keto-1,4-oxazepan-4-yl)phenyl]-2-(3-mesyl-2-naphthyl)-5-methyl-pyrazole-3-carboxamide Formula: C27H25FN4O5S MolecularWeight: 536.574603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)N3CCOCCC3=O)F)C4=CC5=CC=CC=C5C=C4S(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)N3CCOCCC3=O)F)C4=CC5=CC=CC=C5C=C4S(=O)(=O)C

InChI

InChI=1S/C27H25FN4O5S/c1-17-13-24(32(30-17)23-14-18-5-3-4-6-19(18)15-25(23)38(2,35)36)27(34)29-22-8-7-20(16-21(22)28)31-10-12-37-11-9-26(31)33/h3-8,13-16H,9-12H2,1-2H3,(H,29,34)