[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone

Systemtic Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Openeye Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(5-methyl-3-phenyl-isoxazol-4-yl)methanone CAS Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(5-methyl-3-phenyl-4-isoxazolyl)methanone IUPAC Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Traditional Name: [4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-(5-methyl-3-phenyl-isoxazol-4-yl)methanone Formula: C22H22FN3O4S MolecularWeight: 443.491183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O4S/c1-16-20(21(24-30-16)17-6-3-2-4-7-17)22(27)25-12-5-13-26(15-14-25)31(28,29)19-10-8-18(23)9-11-19/h2-4,6-11H,5,12-15H2,1H3