N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-(trifluoromethyl)benzamide Formula: C24H28F3N3O4S MolecularWeight: 511.55703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H28F3N3O4S/c25-24(26,27)19-7-5-6-18(16-19)23(31)28-21-17-20(35(32,33)30-12-14-34-15-13-30)8-9-22(21)29-10-3-1-2-4-11-29/h5-9,16-17H,1-4,10-15H2,(H,28,31)