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5-(4-methylsulfonyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine

5-(4-methylsulfonyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine

Systemtic Name:5-(4-methylsulfonyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine
Openeye Name:5-(4-methylsulfonyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine
CAS Name:5-(4-methylsulfonyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine
IUPAC Name:5-(4-methylsulfonyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine
Traditional Name:5-(4-mesyl-1,4-diazepan-1-yl)-8-phenyl-2-(trifluoromethyl)-1,6-naphthyridine
Formula: C21H21F3N4O2S
MolecularWeight: 450.47725
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CC=CC=C4


Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CC=CC=C4


InChI

InChI=1S/C21H21F3N4O2S/c1-31(29,30)28-11-5-10-27(12-13-28)20-16-8-9-18(21(22,23)24)26-19(16)17(14-25-20)15-6-3-2-4-7-15/h2-4,6-9,14H,5,10-13H2,1H3


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