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

Systemtic Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone Openeye Name: (3-ethyl-5-methyl-isoxazol-4-yl)-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone CAS Name: (3-ethyl-5-methyl-4-isoxazolyl)-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone IUPAC Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone Traditional Name: (3-ethyl-5-methyl-isoxazol-4-yl)-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone Formula: C18H22FN3O4S MolecularWeight: 395.448383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H22FN3O4S/c1-3-16-17(13(2)26-20-16)18(23)21-9-4-10-22(12-11-21)27(24,25)15-7-5-14(19)6-8-15/h5-8H,3-4,9-12H2,1-2H3